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Details

Stereochemistry ACHIRAL
Molecular Formula C18H12N3O5.Na
Molecular Weight 373.2947
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of Sodium 3-hydroxy-4-[(2-methyl-5-nitrophenyl)azo]-2-naphthoate

SMILES

[Na+].CC1=C(C=C(C=C1)[N+]([O-])=O)N=NC2=C3C=CC=CC3=CC(C([O-])=O)=C2O

InChI

InChIKey=QHHULJUZDYVLTJ-RZLHGTIFSA-M
InChI=1S/C18H13N3O5.Na/c1-10-6-7-12(21(25)26)9-15(10)19-20-16-13-5-3-2-4-11(13)8-14(17(16)22)18(23)24;/h2-9,22H,1H3,(H,23,24);/q;+1/p-1/b20-19+;

HIDE SMILES / InChI

Molecular Formula Na
Molecular Weight 22.98976928
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C18H12N3O5
Molecular Weight 350.305
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 19:22:03 GMT 2025
Edited
by admin
on Wed Apr 02 19:22:03 GMT 2025
Record UNII
E8HH66SY9V
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-Naphthalenecarboxylic acid, 3-hydroxy-4-[2-(2-methyl-5-nitrophenyl)diazenyl]-, sodium salt (1:1)
Preferred Name English
Sodium 3-hydroxy-4-[(2-methyl-5-nitrophenyl)azo]-2-naphthoate
Systematic Name English
2-Naphthoic acid, 3-hydroxy-4-[(5-nitro-o-tolyl)azo]-, monosodium salt
Common Name English
Code System Code Type Description
FDA UNII
E8HH66SY9V
Created by admin on Wed Apr 02 19:22:03 GMT 2025 , Edited by admin on Wed Apr 02 19:22:03 GMT 2025
PRIMARY
CAS
14956-77-5
Created by admin on Wed Apr 02 19:22:03 GMT 2025 , Edited by admin on Wed Apr 02 19:22:03 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE