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Acylaminobenzoic acid and derivatives

Organic compounds that consist of a benzoic acid with an acylamino substitution; an acylamino substitution consists of a carbon atom bonded to a carbonyl group that is bonded to a nitrogen atom bonded to a hydrogen atom and an organic group.
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Keyword Search:
1 – 15 of 37 results
1

5-Acetamido-2-aminobenzoic acid, 97%

CAS: 50670-83-2 Molecular Formula: C9H10N2O3 Molecular Weight (g/mol): 194.19 MDL Number: MFCD00060120 InChI Key: GSOHXJQXAKNJES-UHFFFAOYSA-N Synonym: 5-acetamidoanthranilic acid,2-amino-5-acetamidobenzoic acid,benzoic acid, 5-acetylamino-2-amino,5-acetylamino-2-aminobenzoic acid,5-acetamino-2-aminobenzoic acid,5-acetamidoanthranilicacid,acmc-209kp2,5-acetylaminoanthanilic acid,5-acetamido-2-aminobenzoicacid,2-amino-5-acetaminobenzoic acid PubChem CID: 170890 IUPAC Name: 5-acetamido-2-aminobenzoic acid SMILES: CC(=O)NC1=CC(=C(C=C1)N)C(=O)O

PubChem CID 170890
CAS 50670-83-2
Molecular Weight (g/mol) 194.19
MDL Number MFCD00060120
SMILES CC(=O)NC1=CC(=C(C=C1)N)C(=O)O
Synonym 5-acetamidoanthranilic acid,2-amino-5-acetamidobenzoic acid,benzoic acid, 5-acetylamino-2-amino,5-acetylamino-2-aminobenzoic acid,5-acetamino-2-aminobenzoic acid,5-acetamidoanthranilicacid,acmc-209kp2,5-acetylaminoanthanilic acid,5-acetamido-2-aminobenzoicacid,2-amino-5-acetaminobenzoic acid
IUPAC Name 5-acetamido-2-aminobenzoic acid
InChI Key GSOHXJQXAKNJES-UHFFFAOYSA-N
Molecular Formula C9H10N2O3
2

N-(4-Carboxyphenyl)succinamic acid, 99%, Thermo Scientific Chemicals

CAS: 76475-62-2 Molecular Formula: C11H11NO5 Molecular Weight (g/mol): 237.21 MDL Number: MFCD00020530 InChI Key: IOKXKKSBNJCKOY-UHFFFAOYSA-N Synonym: 4-3-carboxypropanamido benzoic acid,4-3-carboxypropanoyl amino benzoic acid,n-4-carboxyphenyl succinamic acid,4-3-carboxypropanoylamino benzoic acid,cbkinase1_000202,cbkinase1_012602,cambridge id 5122038,n-4-carboxyphenyl succinamidic acid,4-2-carboxyethylcarboxamido benzoic acid PubChem CID: 765581 IUPAC Name: 4-(3-carboxypropanoylamino)benzoic acid SMILES: OC(=O)CCC(=O)NC1=CC=C(C=C1)C(O)=O

PubChem CID 765581
CAS 76475-62-2
Molecular Weight (g/mol) 237.21
MDL Number MFCD00020530
SMILES OC(=O)CCC(=O)NC1=CC=C(C=C1)C(O)=O
Synonym 4-3-carboxypropanamido benzoic acid,4-3-carboxypropanoyl amino benzoic acid,n-4-carboxyphenyl succinamic acid,4-3-carboxypropanoylamino benzoic acid,cbkinase1_000202,cbkinase1_012602,cambridge id 5122038,n-4-carboxyphenyl succinamidic acid,4-2-carboxyethylcarboxamido benzoic acid
IUPAC Name 4-(3-carboxypropanoylamino)benzoic acid
InChI Key IOKXKKSBNJCKOY-UHFFFAOYSA-N
Molecular Formula C11H11NO5
3

3-Acetamidobenzoic acid, 98%

CAS: 587-48-4 Molecular Formula: C9H9NO3 Molecular Weight (g/mol): 179.175 MDL Number: MFCD00013983 InChI Key: RGDPZMQZWZMONQ-UHFFFAOYSA-N Synonym: 3-acetylamino benzoic acid,benzoic acid, 3-acetylamino,3-acetylaminobenzoic acid,m-acetylaminobenzoic acid,benzoic acid, m-acetamido,n-acetyl-m-aminobenzoic acid,3-acetylamino-benzoic acid,3-acetylamino-benzoicaci,3-acetamidobenzoicacid,3'-carboxyacetanilide PubChem CID: 48847 IUPAC Name: 3-acetamidobenzoic acid SMILES: CC(=O)NC1=CC=CC(=C1)C(=O)O

PubChem CID 48847
CAS 587-48-4
Molecular Weight (g/mol) 179.175
MDL Number MFCD00013983
SMILES CC(=O)NC1=CC=CC(=C1)C(=O)O
Synonym 3-acetylamino benzoic acid,benzoic acid, 3-acetylamino,3-acetylaminobenzoic acid,m-acetylaminobenzoic acid,benzoic acid, m-acetamido,n-acetyl-m-aminobenzoic acid,3-acetylamino-benzoic acid,3-acetylamino-benzoicaci,3-acetamidobenzoicacid,3'-carboxyacetanilide
IUPAC Name 3-acetamidobenzoic acid
InChI Key RGDPZMQZWZMONQ-UHFFFAOYSA-N
Molecular Formula C9H9NO3
4

4-Acetamido-2-methylbenzoic acid, 96%

CAS: 103204-69-9 Molecular Formula: C10H11NO3 Molecular Weight (g/mol): 193.202 MDL Number: MFCD02258874 InChI Key: AQPDTYYKDYMCTH-UHFFFAOYSA-N Synonym: 4-acetylamino-2-methylbenzoic acid,benzoic acid, 4-acetylamino-2-methyl,4-acetamido-2-methyl-benzoic acid,acmc-20amqf,4-acetamido-o-toluic acid,4'-acetamido-2-methylbenzoicacid,4-acetylamino-2-methyl-benzoic acid,o-toluic acid, 4-acetamido-6ci,n-acetyl-4-amino-2-methyl-benzoic acid PubChem CID: 2735224 IUPAC Name: 4-acetamido-2-methylbenzoic acid SMILES: CC1=C(C=CC(=C1)NC(=O)C)C(=O)O

PubChem CID 2735224
CAS 103204-69-9
Molecular Weight (g/mol) 193.202
MDL Number MFCD02258874
SMILES CC1=C(C=CC(=C1)NC(=O)C)C(=O)O
Synonym 4-acetylamino-2-methylbenzoic acid,benzoic acid, 4-acetylamino-2-methyl,4-acetamido-2-methyl-benzoic acid,acmc-20amqf,4-acetamido-o-toluic acid,4'-acetamido-2-methylbenzoicacid,4-acetylamino-2-methyl-benzoic acid,o-toluic acid, 4-acetamido-6ci,n-acetyl-4-amino-2-methyl-benzoic acid
IUPAC Name 4-acetamido-2-methylbenzoic acid
InChI Key AQPDTYYKDYMCTH-UHFFFAOYSA-N
Molecular Formula C10H11NO3
5

Methyl 2-(acetylamino)-3-nitrobenzoate, 97%, Thermo Scientific™

CAS: 95067-27-9 Molecular Formula: C10H10N2O5 Molecular Weight (g/mol): 238.20 MDL Number: MFCD00157613 InChI Key: PHFRWNCHBPVTJN-UHFFFAOYSA-N Synonym: methyl 2-acetylamino-3-nitrobenzoate,methyl 2-acetamido-3-nitro-benzoate,2-acetylamino-3-nitro-benzoic acid methyl ester,2-acetamido-3-nitrobenzoic acid methyl ester,methyl-2-acetylamino-3-nitrobenzoate,methyl2-acetylamino-3-nitrobenzoate,2-acetylamino-3-nitrobenzoic acid methyl ester PubChem CID: 2782278 IUPAC Name: methyl 2-acetamido-3-nitrobenzoate SMILES: COC(=O)C1=C(NC(C)=O)C(=CC=C1)[N+]([O-])=O

PubChem CID 2782278
CAS 95067-27-9
Molecular Weight (g/mol) 238.20
MDL Number MFCD00157613
SMILES COC(=O)C1=C(NC(C)=O)C(=CC=C1)[N+]([O-])=O
Synonym methyl 2-acetylamino-3-nitrobenzoate,methyl 2-acetamido-3-nitro-benzoate,2-acetylamino-3-nitro-benzoic acid methyl ester,2-acetamido-3-nitrobenzoic acid methyl ester,methyl-2-acetylamino-3-nitrobenzoate,methyl2-acetylamino-3-nitrobenzoate,2-acetylamino-3-nitrobenzoic acid methyl ester
IUPAC Name methyl 2-acetamido-3-nitrobenzoate
InChI Key PHFRWNCHBPVTJN-UHFFFAOYSA-N
Molecular Formula C10H10N2O5
6

N-Succinimidyl 3-maleimidobenzoate, 95%

CAS: 58626-38-3 Molecular Formula: C15H10N2O6 Molecular Weight (g/mol): 314.253 MDL Number: MFCD00005514 InChI Key: LLXVXPPXELIDGQ-UHFFFAOYSA-N Synonym: 3-maleimidobenzoic acid n-hydroxysuccinimide ester,n-succinimidyl 3-maleimidobenzoate,3-maleimidobenzoyl n-hydroxysuccinimide,1-3-2,5-dioxopyrrolidinyl oxy carbonyl phenyl-1h-pyrrole-2,5-dione,m-maleimidobenzoyl-n-hydroxysuccinimide ester,2,5-dioxopyrrolidin-1-yl 3-2,5-dioxopyrrol-1-yl benzoate,3-n-maleimidobenzoic acid n-succinimidyl ester,2,5-dioxopyrrolidin-1-yl 3-2,5-dioxo-2,5-dihydro-1h-pyrrol-1-yl benzoate,ambotzpeg2090 PubChem CID: 93861 IUPAC Name: (2,5-dioxopyrrolidin-1-yl) 3-(2,5-dioxopyrrol-1-yl)benzoate SMILES: C1CC(=O)N(C1=O)OC(=O)C2=CC(=CC=C2)N3C(=O)C=CC3=O

PubChem CID 93861
CAS 58626-38-3
Molecular Weight (g/mol) 314.253
MDL Number MFCD00005514
SMILES C1CC(=O)N(C1=O)OC(=O)C2=CC(=CC=C2)N3C(=O)C=CC3=O
Synonym 3-maleimidobenzoic acid n-hydroxysuccinimide ester,n-succinimidyl 3-maleimidobenzoate,3-maleimidobenzoyl n-hydroxysuccinimide,1-3-2,5-dioxopyrrolidinyl oxy carbonyl phenyl-1h-pyrrole-2,5-dione,m-maleimidobenzoyl-n-hydroxysuccinimide ester,2,5-dioxopyrrolidin-1-yl 3-2,5-dioxopyrrol-1-yl benzoate,3-n-maleimidobenzoic acid n-succinimidyl ester,2,5-dioxopyrrolidin-1-yl 3-2,5-dioxo-2,5-dihydro-1h-pyrrol-1-yl benzoate,ambotzpeg2090
IUPAC Name (2,5-dioxopyrrolidin-1-yl) 3-(2,5-dioxopyrrol-1-yl)benzoate
InChI Key LLXVXPPXELIDGQ-UHFFFAOYSA-N
Molecular Formula C15H10N2O6
9

Iodixanol, TRC

CAS: 92339-11-2 Molecular Formula: C35 H44 I6 N6 O15 Molecular Weight (g/mol): 1550.18 Synonym: 5,5'-[(2-Hydroxy-1,3-propanediyl)bis(acetylimino)]bis[N,N'-bis(2,3-dihydroxypropyl)-2,4,6-triiodo-1,3-benzenedicarboxamide,2-5410-3A,Iodixanol,OptiPrep,Visipaque,Visipaque 270 IUPAC Name: 5-[acetyl-[3-[N-acetyl-3,5-bis(2,3-dihydroxypropylcarbamoyl)-2,4,6-triiodoanilino]-2-hydroxypropyl]amino]-1-N,3-N-bis(2,3-dihydroxypropyl)-2,4,6-triiodobenzene-1,3-dicarboxamide SMILES: CC(=O)N(CC(O)CN(C(=O)C)c1c(I)c(C(=O)NCC(O)CO)c(I)c(C(=O)NCC(O)CO)c1I)c2c(I)c(C(=O)NCC(O)CO)c(I)c(C(=O)NCC(O)CO)c2I

CAS 92339-11-2
Molecular Weight (g/mol) 1550.18
SMILES CC(=O)N(CC(O)CN(C(=O)C)c1c(I)c(C(=O)NCC(O)CO)c(I)c(C(=O)NCC(O)CO)c1I)c2c(I)c(C(=O)NCC(O)CO)c(I)c(C(=O)NCC(O)CO)c2I
Synonym 5,5'-[(2-Hydroxy-1,3-propanediyl)bis(acetylimino)]bis[N,N'-bis(2,3-dihydroxypropyl)-2,4,6-triiodo-1,3-benzenedicarboxamide,2-5410-3A,Iodixanol,OptiPrep,Visipaque,Visipaque 270
IUPAC Name 5-[acetyl-[3-[N-acetyl-3,5-bis(2,3-dihydroxypropylcarbamoyl)-2,4,6-triiodoanilino]-2-hydroxypropyl]amino]-1-N,3-N-bis(2,3-dihydroxypropyl)-2,4,6-triiodobenzene-1,3-dicarboxamide
Molecular Formula C35 H44 I6 N6 O15
10

Carboxyformamido Metazachlor Benzoic Acid, TRC

CAS: 1367578-41-3 Molecular Formula: C14 H13 N3 O5 Molecular Weight (g/mol): 303.27 Synonym: Metazachlor Metabolite BH 479-12,Benzoic acid, 2-[(carboxycarbonyl)(1H-pyrazol-1-ylmethyl)amino]-3-methyl- IUPAC Name: 3-methyl-2-[oxalo(pyrazol-1-ylmethyl)amino]benzoic acid SMILES: Cc1cccc(C(=O)O)c1N(Cn2cccn2)C(=O)C(=O)O

CAS 1367578-41-3
Molecular Weight (g/mol) 303.27
SMILES Cc1cccc(C(=O)O)c1N(Cn2cccn2)C(=O)C(=O)O
Synonym Metazachlor Metabolite BH 479-12,Benzoic acid, 2-[(carboxycarbonyl)(1H-pyrazol-1-ylmethyl)amino]-3-methyl-
IUPAC Name 3-methyl-2-[oxalo(pyrazol-1-ylmethyl)amino]benzoic acid
Molecular Formula C14 H13 N3 O5
11

Ethopabate, TRC

CAS: 59-06-3 Molecular Formula: C12 H15 N O4 Molecular Weight (g/mol): 237.25 Synonym: Benzoic acid, 4-(acetylamino)-2-ethoxy-, methyl ester,Benzoic acid, 4-acetamido-2-ethoxy-, methyl ester (7CI,8CI),4-Acetamido-2-ethoxybenzoic acid methyl ester,Ethopabate,Ethyl pabate,Methyl 2-ethoxy-4-acetamidobenzoate,Methyl 4-(acetylamino)-2-ethoxybenzoate,Methyl 4-acetamido-2-ethoxybenzoate IUPAC Name: methyl 4-acetamido-2-ethoxybenzoate SMILES: CCOc1cc(NC(=O)C)ccc1C(=O)OC

CAS 59-06-3
Molecular Weight (g/mol) 237.25
SMILES CCOc1cc(NC(=O)C)ccc1C(=O)OC
Synonym Benzoic acid, 4-(acetylamino)-2-ethoxy-, methyl ester,Benzoic acid, 4-acetamido-2-ethoxy-, methyl ester (7CI,8CI),4-Acetamido-2-ethoxybenzoic acid methyl ester,Ethopabate,Ethyl pabate,Methyl 2-ethoxy-4-acetamidobenzoate,Methyl 4-(acetylamino)-2-ethoxybenzoate,Methyl 4-acetamido-2-ethoxybenzoate
IUPAC Name methyl 4-acetamido-2-ethoxybenzoate
Molecular Formula C12 H15 N O4
12

Methyl 4-Acetamido-5-bromo-2-methoxybenzoate, TRC

CAS: 4093-34-9 Molecular Formula: C11H12BrNO4 Molecular Weight (g/mol): 302.12 Synonym: 4-Acetamido-5-bromo-o-anisic Acid Methyl Ester,4-(Acetylamino)-5-bromo-2-methoxy-benzoic Acid Methyl Ester,Bromopride Impurity B IUPAC Name: methyl 4-acetamido-5-bromo-2-methoxybenzoate SMILES: COC(=O)c1cc(Br)c(NC(=O)C)cc1OC

CAS 4093-34-9
Molecular Weight (g/mol) 302.12
SMILES COC(=O)c1cc(Br)c(NC(=O)C)cc1OC
Synonym 4-Acetamido-5-bromo-o-anisic Acid Methyl Ester,4-(Acetylamino)-5-bromo-2-methoxy-benzoic Acid Methyl Ester,Bromopride Impurity B
IUPAC Name methyl 4-acetamido-5-bromo-2-methoxybenzoate
Molecular Formula C11H12BrNO4
13

Methyl 4-Acetylamino-5-chloro-2-methoxybenzoate, TRC

CAS: 4093-31-6 Molecular Formula: C11 H12 Cl N O4 Molecular Weight (g/mol): 257.67 Synonym: Methyl 4-(Acetylamino)-5-chloro-2-methoxybenzoate,Metoclopramide Imp. B (EP) IUPAC Name: methyl 4-acetamido-5-chloro-2-methoxybenzoate SMILES: COC(=O)c1cc(Cl)c(NC(=O)C)cc1OC

CAS 4093-31-6
Molecular Weight (g/mol) 257.67
SMILES COC(=O)c1cc(Cl)c(NC(=O)C)cc1OC
Synonym Methyl 4-(Acetylamino)-5-chloro-2-methoxybenzoate,Metoclopramide Imp. B (EP)
IUPAC Name methyl 4-acetamido-5-chloro-2-methoxybenzoate
Molecular Formula C11 H12 Cl N O4
14

Methyl 4-Acetamido-2-methoxybenzoate, TRC

CAS: 4093-29-2 Molecular Formula: C11 H13 N O4 Molecular Weight (g/mol): 223.23 Synonym: Methyl 4-(Acetylamino)-2-methoxybenzoate,Metoclopramide Imp. D (EP),Metoclopramide Imp. D (EP),Metoclopramide USP Related Compound D,Metoclopramide USP RC D,Methyl 4-(Acetylamino)-2-methoxybenzoate,Metoclopramide Related Compound D,Metoclopramide Hydrochloride Monohydrate Impurity D,Metoclopramide Impurity D IUPAC Name: methyl 4-acetamido-2-methoxybenzoate SMILES: COC(=O)c1ccc(NC(=O)C)cc1OC

CAS 4093-29-2
Molecular Weight (g/mol) 223.23
SMILES COC(=O)c1ccc(NC(=O)C)cc1OC
Synonym Methyl 4-(Acetylamino)-2-methoxybenzoate,Metoclopramide Imp. D (EP),Metoclopramide Imp. D (EP),Metoclopramide USP Related Compound D,Metoclopramide USP RC D,Methyl 4-(Acetylamino)-2-methoxybenzoate,Metoclopramide Related Compound D,Metoclopramide Hydrochloride Monohydrate Impurity D,Metoclopramide Impurity D
IUPAC Name methyl 4-acetamido-2-methoxybenzoate
Molecular Formula C11 H13 N O4
15

N-Acetal Bromopride, TRC

CAS: 94135-22-5 Molecular Formula: C16H24BrN3O3 Molecular Weight (g/mol): 386.28 Synonym: 4-(Acetylamino)-5-bromo-N-[2-(diethylamino)ethyl]-2-methoxy-benzamide,Bromopride Impurity A IUPAC Name: 4-acetamido-5-bromo-N-[2-(diethylamino)ethyl]-2-methoxybenzamide SMILES: CCN(CC)CCNC(=O)c1cc(Br)c(NC(=O)C)cc1OC

CAS 94135-22-5
Molecular Weight (g/mol) 386.28
SMILES CCN(CC)CCNC(=O)c1cc(Br)c(NC(=O)C)cc1OC
Synonym 4-(Acetylamino)-5-bromo-N-[2-(diethylamino)ethyl]-2-methoxy-benzamide,Bromopride Impurity A
IUPAC Name 4-acetamido-5-bromo-N-[2-(diethylamino)ethyl]-2-methoxybenzamide
Molecular Formula C16H24BrN3O3