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Details

Stereochemistry ACHIRAL
Molecular Formula C35H25N9O8S2
Molecular Weight 763.758
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 3
Charge 0

SHOW SMILES / InChI
Structure of 2,7-NAPHTHALENEDISULFONIC ACID, 4-AMINO-5-HYDROXY-3-((4-(5-((4-HYDROXYPHENYL)AZO)-1H-BENZIMIDAZOL-2-YL)PHENYL)AZO)-6-(PHENYLAZO)-

SMILES

NC1=C2C(=CC(=C1N=NC3=CC=C(C=C3)C4=NC5=C(N4)C=C(C=C5)N=NC6=CC=C(O)C=C6)S(O)(=O)=O)C=C(C(N=NC7=CC=CC=C7)=C2O)S(O)(=O)=O

InChI

InChIKey=YWFVUINYAWNXHH-AUVAVNHBSA-N
InChI=1S/C35H25N9O8S2/c36-31-30-20(17-29(54(50,51)52)33(34(30)46)44-40-21-4-2-1-3-5-21)16-28(53(47,48)49)32(31)43-41-22-8-6-19(7-9-22)35-37-26-15-12-24(18-27(26)38-35)42-39-23-10-13-25(45)14-11-23/h1-18,45-46H,36H2,(H,37,38)(H,47,48,49)(H,50,51,52)/b42-39+,43-41+,44-40+

HIDE SMILES / InChI

Molecular Formula C35H25N9O8S2
Molecular Weight 763.758
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 3
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 17:42:40 GMT 2025
Edited
by admin
on Tue Apr 01 17:42:40 GMT 2025
Record UNII
L6K3SMT7ZR
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2,7-Naphthalenedisulfonic acid, 4-amino-5-hydroxy-3-[2-[4-[6-[2-(4-hydroxyphenyl)diazenyl]-1H-benzimidazol-2-yl]phenyl]diazenyl]-6-(2-phenyldiazenyl)-
Preferred Name English
2,7-NAPHTHALENEDISULFONIC ACID, 4-AMINO-5-HYDROXY-3-((4-(5-((4-HYDROXYPHENYL)AZO)-1H-BENZIMIDAZOL-2-YL)PHENYL)AZO)-6-(PHENYLAZO)-
Common Name English
4-Amino-5-hydroxy-3-[2-[4-[6-[2-(4-hydroxyphenyl)diazenyl]-1H-benzimidazol-2-yl]phenyl]diazenyl]-6-(2-phenyldiazenyl)-2,7-naphthalenedisulfonic acid
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
267-368-4
Created by admin on Tue Apr 01 17:42:40 GMT 2025 , Edited by admin on Tue Apr 01 17:42:40 GMT 2025
PRIMARY
EPA CompTox
DTXSID8070708
Created by admin on Tue Apr 01 17:42:40 GMT 2025 , Edited by admin on Tue Apr 01 17:42:40 GMT 2025
PRIMARY
FDA UNII
L6K3SMT7ZR
Created by admin on Tue Apr 01 17:42:40 GMT 2025 , Edited by admin on Tue Apr 01 17:42:40 GMT 2025
PRIMARY
CAS
67846-55-3
Created by admin on Tue Apr 01 17:42:40 GMT 2025 , Edited by admin on Tue Apr 01 17:42:40 GMT 2025
PRIMARY
PUBCHEM
135853526
Created by admin on Tue Apr 01 17:42:40 GMT 2025 , Edited by admin on Tue Apr 01 17:42:40 GMT 2025
PRIMARY