4-(Methylamino)-3-nitrobenzoic acid

U.S. Department of Health & Human Services Divider Arrow

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C8H8N2O4
Molecular Weight	196.1601
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4-(Methylamino)-3-nitrobenzoic acid

Structure Search

SMILES

CNC1=C(C=C(C=C1)C(O)=O)[N+]([O-])=O

InChI

InChIKey=KSMLIIWEQBYUKA-UHFFFAOYSA-N

InChI=1S/C8H8N2O4/c1-9-6-3-2-5(8(11)12)4-7(6)10(13)14/h2-4,9H,1H3,(H,11,12)

HIDE SMILES / InChI

Molecular Formula	C8H8N2O4
Molecular Weight	196.1601
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 23:42:50 GMT 2025` Edited by `admin` on `Mon Mar 31 23:42:50 GMT 2025`
Record UNII	W3XW4KR39J
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

4-(Methylamino)-3-nitrobenzoic acid

Systematic Name

English

NSC-138300

Preferred Name

English

Benzoic acid, 4-(methylamino)-3-nitro-

Systematic Name

English

Code System Code Type Description

CAS

41263-74-5

Created by admin on Mon Mar 31 23:42:50 GMT 2025 , Edited by admin on Mon Mar 31 23:42:50 GMT 2025

PRIMARY

EPA CompTox

DTXSID20300675

Created by admin on Mon Mar 31 23:42:50 GMT 2025 , Edited by admin on Mon Mar 31 23:42:50 GMT 2025

PRIMARY

NSC

138300

Created by admin on Mon Mar 31 23:42:50 GMT 2025 , Edited by admin on Mon Mar 31 23:42:50 GMT 2025

PRIMARY

PUBCHEM

7063595

Created by admin on Mon Mar 31 23:42:50 GMT 2025 , Edited by admin on Mon Mar 31 23:42:50 GMT 2025

PRIMARY

FDA UNII

W3XW4KR39J

Created by admin on Mon Mar 31 23:42:50 GMT 2025 , Edited by admin on Mon Mar 31 23:42:50 GMT 2025

PRIMARY