7-Amino-8-[[4-(2-sulfooxyethylsulfonyl)phenyl]diazenyl]naphthalene-2-sulfonic acid, disodium salt

Details

Stereochemistry	ACHIRAL
Molecular Formula	C18H15N3O9S3.2Na
Molecular Weight	559.501
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of 7-Amino-8-[[4-(2-sulfooxyethylsulfonyl)phenyl]diazenyl]naphthalene-2-sulfonic acid, disodium salt

Structure Search

SMILES

[Na+].[Na+].NC1=C(\N=N\C2=CC=C(C=C2)S(=O)(=O)CCOS([O-])(=O)=O)C3=C(C=C1)C=CC(=C3)S([O-])(=O)=O

InChI

InChIKey=XTFLBKFLGRTWSC-SERMZQFOSA-L

InChI=1S/C18H17N3O9S3.2Na/c19-17-8-2-12-1-5-15(32(24,25)26)11-16(12)18(17)21-20-13-3-6-14(7-4-13)31(22,23)10-9-30-33(27,28)29;;/h1-8,11H,9-10,19H2,(H,24,25,26)(H,27,28,29);;/q;2*+1/p-2/b21-20+;;

HIDE SMILES / InChI

Molecular Formula	C18H15N3O9S3
Molecular Weight	513.521
Charge	-2
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

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

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 18:26:55 GMT 2025` Edited by `admin` on `Tue Apr 01 18:26:55 GMT 2025`
Record UNII	YE5BG7U3R3
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

7-Amino-8-[[4-(2-sulfooxyethylsulfonyl)phenyl]diazenyl]naphthalene-2-sulfonic acid, disodium salt

Systematic Name

English

7-Amino-8-((4-((2-(sulfooxy)ethyl)sulfonyl)phenyl)azo)naphthalene-2-sulfonic acid, disodium salt

Preferred Name

English

2-Naphthalenesulfonic acid, 7-amino-8-[2-[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]diazenyl]-, sodium salt

Systematic Name

English

Code System Code Type Description

FDA UNII

YE5BG7U3R3