4-(Benzoylamino)-5-hydroxy-6-[2-[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]diazenyl]-1,7-naphthalenedisulfonic acid

Details

Stereochemistry	ACHIRAL
Molecular Formula	C25H21N3O14S4
Molecular Weight	715.706
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of 4-(Benzoylamino)-5-hydroxy-6-[2-[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]diazenyl]-1,7-naphthalenedisulfonic acid

Structure Search

SMILES

OC1=C(\N=N\C2=CC=C(C=C2)S(=O)(=O)CCOS(O)(=O)=O)C(=CC3=C(C=CC(NC(=O)C4=CC=CC=C4)=C13)S(O)(=O)=O)S(O)(=O)=O

InChI

InChIKey=RSAJRSTYJBDQBB-BYYHNAKLSA-N

InChI=1S/C25H21N3O14S4/c29-24-22-18(20(44(33,34)35)11-10-19(22)26-25(30)15-4-2-1-3-5-15)14-21(45(36,37)38)23(24)28-27-16-6-8-17(9-7-16)43(31,32)13-12-42-46(39,40)41/h1-11,14,29H,12-13H2,(H,26,30)(H,33,34,35)(H,36,37,38)(H,39,40,41)/b28-27+

HIDE SMILES / InChI

Approval Year

Name

Type

Language

1,7-Naphthalenedisulfonic acid, 4-(benzoylamino)-5-hydroxy-6-[[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]azo]-

Preferred Name

English

4-(Benzoylamino)-5-hydroxy-6-[2-[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]diazenyl]-1,7-naphthalenedisulfonic acid

Systematic Name

English

1,7-Naphthalenedisulfonic acid, 4-(benzoylamino)-5-hydroxy-6-[2-[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]diazenyl]-

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID5067766