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Details

Stereochemistry ACHIRAL
Molecular Formula C8H7NO6
Molecular Weight 213.1443
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-Hydroxy-3-methoxy-5-nitrobenzoic acid

SMILES

COC1=C(O)C(=CC(=C1)C(O)=O)[N+]([O-])=O

InChI

InChIKey=AEDVAGWYAKIOIM-UHFFFAOYSA-N
InChI=1S/C8H7NO6/c1-15-6-3-4(8(11)12)2-5(7(6)10)9(13)14/h2-3,10H,1H3,(H,11,12)

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
4-Hydroxy-3-methoxy-5-nitrobenzoic acid
Systematic Name English
5-Nitrovanillic acid
Preferred Name English
Benzoic acid, 4-hydroxy-3-methoxy-5-nitro-
Systematic Name English
3-Nitro-4-hydroxy-5-methoxybenzoic acid
Systematic Name English
Code System Code Type Description
PUBCHEM
15527939
Created by admin on Wed Apr 02 18:40:13 GMT 2025 , Edited by admin on Wed Apr 02 18:40:13 GMT 2025
PRIMARY
EPA CompTox
DTXSID80573686
Created by admin on Wed Apr 02 18:40:13 GMT 2025 , Edited by admin on Wed Apr 02 18:40:13 GMT 2025
PRIMARY
FDA UNII
6E26LY4BE4
Created by admin on Wed Apr 02 18:40:13 GMT 2025 , Edited by admin on Wed Apr 02 18:40:13 GMT 2025
PRIMARY
CAS
15785-54-3
Created by admin on Wed Apr 02 18:40:13 GMT 2025 , Edited by admin on Wed Apr 02 18:40:13 GMT 2025
PRIMARY
NIH
NCATS
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