U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C9H9N3O4
Molecular Weight 223.1855
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-(((METHYLNITROSOAMINO)CARBONYL)AMINO)BENZOIC ACID

SMILES

CN(N=O)C(=O)NC1=CC=C(C=C1)C(O)=O

InChI

InChIKey=LUAOYJDDQIIDIN-UHFFFAOYSA-N
InChI=1S/C9H9N3O4/c1-12(11-16)9(15)10-7-4-2-6(3-5-7)8(13)14/h2-5H,1H3,(H,10,15)(H,13,14)

HIDE SMILES / InChI

Approval Year

Name Type Language
NSC-409719
Preferred Name English
4-(((METHYLNITROSOAMINO)CARBONYL)AMINO)BENZOIC ACID
Systematic Name English
BENZOIC ACID, P-(3-METHYL-3-NITROSOUREIDO)-
Common Name English
BENZOIC ACID, 4-(((METHYLNITROSOAMINO)CARBONYL)AMINO)-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID70238095
Created by admin on Tue Apr 01 20:28:33 GMT 2025 , Edited by admin on Tue Apr 01 20:28:33 GMT 2025
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NSC
409719
Created by admin on Tue Apr 01 20:28:33 GMT 2025 , Edited by admin on Tue Apr 01 20:28:33 GMT 2025
PRIMARY
FDA UNII
I0CW01SEA7
Created by admin on Tue Apr 01 20:28:33 GMT 2025 , Edited by admin on Tue Apr 01 20:28:33 GMT 2025
PRIMARY
CAS
90349-65-8
Created by admin on Tue Apr 01 20:28:33 GMT 2025 , Edited by admin on Tue Apr 01 20:28:33 GMT 2025
PRIMARY
PUBCHEM
101388
Created by admin on Tue Apr 01 20:28:33 GMT 2025 , Edited by admin on Tue Apr 01 20:28:33 GMT 2025
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