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Details

Stereochemistry ACHIRAL
Molecular Formula C18H13N2O11S3.3Na
Molecular Weight 598.467
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of TRISODIUM 7-HYDROXY-8-((2-METHOXY-5-METHYL-4-SULFOPHENYL)AZO)-1,3-NAPHTHALENEDISULFONATE

SMILES

[Na+].[Na+].[Na+].COC1=C(C=C(C)C(=C1)S([O-])(=O)=O)\N=N\C2=C(O)C=CC3=CC(=CC(=C23)S([O-])(=O)=O)S([O-])(=O)=O

InChI

InChIKey=RFXURVMKQJEHAE-HVARVCSCSA-K
InChI=1S/C18H16N2O11S3.3Na/c1-9-5-12(14(31-2)8-15(9)33(25,26)27)19-20-18-13(21)4-3-10-6-11(32(22,23)24)7-16(17(10)18)34(28,29)30;;;/h3-8,21H,1-2H3,(H,22,23,24)(H,25,26,27)(H,28,29,30);;;/q;3*+1/p-3/b20-19+;;;

HIDE SMILES / InChI

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

Molecular Formula C18H13N2O11S3
Molecular Weight 529.498
Charge -3
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 Sat Dec 16 11:43:29 GMT 2023
Edited
by admin
on Sat Dec 16 11:43:29 GMT 2023
Record UNII
N5521DH3GD
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TRISODIUM 7-HYDROXY-8-((2-METHOXY-5-METHYL-4-SULFOPHENYL)AZO)-1,3-NAPHTHALENEDISULFONATE
Common Name English
CRESIDINE SULFONIC ACID AZO G SALT COLOR STANDARD
Common Name English
1,3-NAPHTHALENEDISULFONIC ACID, 7-HYDROXY-8-(2-(2-METHOXY-5-METHYL-4-SULFOPHENYL)DIAZENYL)-, SODIUM SALT (1:3)
Systematic Name English
Code System Code Type Description
FDA UNII
N5521DH3GD
Created by admin on Sat Dec 16 11:43:29 GMT 2023 , Edited by admin on Sat Dec 16 11:43:29 GMT 2023
PRIMARY
CAS
374784-31-3
Created by admin on Sat Dec 16 11:43:29 GMT 2023 , Edited by admin on Sat Dec 16 11:43:29 GMT 2023
PRIMARY
PUBCHEM
123133517
Created by admin on Sat Dec 16 11:43:29 GMT 2023 , Edited by admin on Sat Dec 16 11:43:29 GMT 2023
PRIMARY