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Details

Stereochemistry ACHIRAL
Molecular Formula C9H7NO6
Molecular Weight 225.155
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-Methoxycarbonyl-2-nitrobenzoic acid

SMILES

COC(=O)C1=CC=C(C(=C1)C(O)=O)[N+]([O-])=O

InChI

InChIKey=MJSJVFTZSILELE-UHFFFAOYSA-N
InChI=1S/C9H7NO6/c1-16-9(13)5-2-3-7(10(14)15)6(4-5)8(11)12/h2-4H,1H3,(H,11,12)

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
1,3-Benzenedicarboxylic acid, 4-nitro-, 1-methyl ester
Preferred Name English
5-Methoxycarbonyl-2-nitrobenzoic acid
Systematic Name English
1-Methyl 4-nitro-1,3-benzenedicarboxylate
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID80565748
Created by admin on Wed Apr 02 17:56:29 GMT 2025 , Edited by admin on Wed Apr 02 17:56:29 GMT 2025
PRIMARY
CAS
76143-33-4
Created by admin on Wed Apr 02 17:56:29 GMT 2025 , Edited by admin on Wed Apr 02 17:56:29 GMT 2025
PRIMARY
FDA UNII
ZPC7CM4ZHP
Created by admin on Wed Apr 02 17:56:29 GMT 2025 , Edited by admin on Wed Apr 02 17:56:29 GMT 2025
PRIMARY
PUBCHEM
14938098
Created by admin on Wed Apr 02 17:56:29 GMT 2025 , Edited by admin on Wed Apr 02 17:56:29 GMT 2025
PRIMARY
NIH
NCATS
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