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Details

Stereochemistry ACHIRAL
Molecular Formula C20H17N4O5S.Na
Molecular Weight 448.428
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of SODIUM 4-((3-(2,5-DIMETHYLPHENYL)DIAZENYL)-2,4-DIHYDROXYPHENYL)DIAZENYL)BENZENESULFONATE

SMILES

[Na+].CC1=CC=C(C)C(=C1)\N=N\C2=C(O)C=CC(\N=N\C3=CC=C(C=C3)S([O-])(=O)=O)=C2O

InChI

InChIKey=IVWHWHAEDIKWEU-HQHRKKNHSA-M
InChI=1S/C20H18N4O5S.Na/c1-12-3-4-13(2)17(11-12)23-24-19-18(25)10-9-16(20(19)26)22-21-14-5-7-15(8-6-14)30(27,28)29;/h3-11,25-26H,1-2H3,(H,27,28,29);/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 Na
Molecular Weight 22.9898
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 Fri Dec 15 15:42:50 GMT 2023
Edited
by admin
on Fri Dec 15 15:42:50 GMT 2023
Record UNII
AU102S3G8Q
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SODIUM 4-((3-(2,5-DIMETHYLPHENYL)DIAZENYL)-2,4-DIHYDROXYPHENYL)DIAZENYL)BENZENESULFONATE
Common Name English
Code System Code Type Description
FDA UNII
AU102S3G8Q
Created by admin on Fri Dec 15 15:42:50 GMT 2023 , Edited by admin on Fri Dec 15 15:42:50 GMT 2023
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