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Details

Stereochemistry ACHIRAL
Molecular Formula C17H13N3O6S
Molecular Weight 387.367
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of Benzoic acid, 2-[2-(7-amino-1-hydroxy-3-sulfo-2-naphthalenyl)diazenyl]-

SMILES

NC1=CC2=C(O)C(\N=N\C3=CC=CC=C3C(O)=O)=C(C=C2C=C1)S(O)(=O)=O

InChI

InChIKey=LMNNNKFIURSGQL-FMQUCBEESA-N
InChI=1S/C17H13N3O6S/c18-10-6-5-9-7-14(27(24,25)26)15(16(21)12(9)8-10)20-19-13-4-2-1-3-11(13)17(22)23/h1-8,21H,18H2,(H,22,23)(H,24,25,26)/b20-19+

HIDE SMILES / InChI

Molecular Formula C17H13N3O6S
Molecular Weight 387.367
Charge 0
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 17:51:46 GMT 2025
Edited
by admin
on Wed Apr 02 17:51:46 GMT 2025
Record UNII
Q8UK6BG9AS
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Benzoic acid, 2-[2-(7-amino-1-hydroxy-3-sulfo-2-naphthalenyl)diazenyl]-
Systematic Name English
2-[2-(7-Amino-1-hydroxy-3-sulfo-2-naphthalenyl)diazenyl]benzoic acid
Preferred Name English
Code System Code Type Description
FDA UNII
Q8UK6BG9AS
Created by admin on Wed Apr 02 17:51:46 GMT 2025 , Edited by admin on Wed Apr 02 17:51:46 GMT 2025
PRIMARY
CAS
518329-26-5
Created by admin on Wed Apr 02 17:51:46 GMT 2025 , Edited by admin on Wed Apr 02 17:51:46 GMT 2025
PRIMARY
Related Record Type Details
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