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Details

Stereochemistry ACHIRAL
Molecular Formula C20H17N4O5S.Li
Molecular Weight 432.379
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of Lithium 3-[[4-[(4-hydroxy-3-methylphenyl)azo]-3-methoxyphenyl]azo]benzenesulfonate

SMILES

[Li+].COC1=C(C=CC(=C1)\N=N\C2=CC(=CC=C2)S([O-])(=O)=O)\N=N\C3=CC(C)=C(O)C=C3

InChI

InChIKey=GRIZQMWEBPFUCN-HQHRKKNHSA-M
InChI=1S/C20H18N4O5S.Li/c1-13-10-15(7-9-19(13)25)23-24-18-8-6-16(12-20(18)29-2)22-21-14-4-3-5-17(11-14)30(26,27)28;/h3-12,25H,1-2H3,(H,26,27,28);/q;+1/p-1/b22-21+,24-23+;

HIDE SMILES / InChI

Molecular Formula C20H17N4O5S
Molecular Weight 425.438
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 2
Optical Activity NONE

Molecular Formula Li
Molecular Weight 6.941
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 16:58:23 GMT 2025
Edited
by admin
on Tue Apr 01 16:58:23 GMT 2025
Record UNII
F35SV33VKV
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Benzenesulfonic acid, 3-[[4-[(4-hydroxy-3-methylphenyl)azo]-3-methoxyphenyl]azo]-, monolithium salt
Preferred Name English
Lithium 3-[[4-[(4-hydroxy-3-methylphenyl)azo]-3-methoxyphenyl]azo]benzenesulfonate
Systematic Name English
Benzenesulfonic acid, 3-[2-[4-[2-(4-hydroxy-3-methylphenyl)diazenyl]-3-methoxyphenyl]diazenyl]-, lithium salt (1:1)
Systematic Name English
Benzenesulfonic acid, 3-[2-[4-[2-(4-hydroxy-3-methylphenyl)diazenyl]-3-methoxyphenyl]diazenyl]-, lithium salt
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID6068698
Created by admin on Tue Apr 01 16:58:23 GMT 2025 , Edited by admin on Tue Apr 01 16:58:23 GMT 2025
PRIMARY
CAS
51988-24-0
Created by admin on Tue Apr 01 16:58:23 GMT 2025 , Edited by admin on Tue Apr 01 16:58:23 GMT 2025
PRIMARY
FDA UNII
F35SV33VKV
Created by admin on Tue Apr 01 16:58:23 GMT 2025 , Edited by admin on Tue Apr 01 16:58:23 GMT 2025
PRIMARY
ECHA (EC/EINECS)
257-584-7
Created by admin on Tue Apr 01 16:58:23 GMT 2025 , Edited by admin on Tue Apr 01 16:58:23 GMT 2025
PRIMARY