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Details

Stereochemistry ACHIRAL
Molecular Formula C36H22N7O10S3.3Na
Molecular Weight 877.765
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 3
Charge 0

SHOW SMILES / InChI
Structure of TRISODIUM 5-((7-AMINO-1-HYDROXY-3-SULFO-2-NAPHTHALENYL)AZO)-8-((4-(PHENYLAZO)-7-SULFO-1-NAPHTHALENYL)AZO)-2-NAPHTHALENESULFONATE

SMILES

[Na+].[Na+].[Na+].NC1=CC=C2C=C(C(\N=N\C3=CC=C(\N=N\C4=CC=C(\N=N\C5=CC=CC=C5)C6=CC=C(C=C46)S([O-])(=O)=O)C7=CC(=CC=C37)S([O-])(=O)=O)=C(O)C2=C1)S([O-])(=O)=O

InChI

InChIKey=GLMGZPBESXZAHR-AFZDYOOLSA-K
InChI=1S/C36H25N7O10S3.3Na/c37-21-7-6-20-16-34(56(51,52)53)35(36(44)27(20)17-21)43-42-31-13-15-33(29-19-24(55(48,49)50)9-11-26(29)31)41-40-32-14-12-30(39-38-22-4-2-1-3-5-22)25-10-8-23(18-28(25)32)54(45,46)47;;;/h1-19,44H,37H2,(H,45,46,47)(H,48,49,50)(H,51,52,53);;;/q;3*+1/p-3/b39-38+,41-40+,43-42+;;;

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 C36H22N7O10S3
Molecular Weight 808.796
Charge -3
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 Sat Dec 16 10:53:33 GMT 2023
Edited
by admin
on Sat Dec 16 10:53:33 GMT 2023
Record UNII
53J326549K
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TRISODIUM 5-((7-AMINO-1-HYDROXY-3-SULFO-2-NAPHTHALENYL)AZO)-8-((4-(PHENYLAZO)-7-SULFO-1-NAPHTHALENYL)AZO)-2-NAPHTHALENESULFONATE
Common Name English
2-NAPHTHALENESULFONIC ACID, 5-((7-AMINO-1-HYDROXY-3-SULFO-2-NAPHTHALENYL)AZO)-8-((4-(PHENYLAZO)-7-SULFO-1-NAPHTHALENYL)AZO)-, TRISODIUM SALT
Systematic Name English
2-NAPHTHALENESULFONIC ACID, 5-((7-AMINO-1-HYDROXY-3-SULFO-2-NAPHTHALENYL)AZO)-8-((4-(PHENYLAZO)-7-SULFO-1-NAPHTHALENYL)AZO)-, TRISODIUM
Common Name English
2-NAPHTHALENESULFONIC ACID, 5-(2-(7-AMINO-1-HYDROXY-3-SULFO-2-NAPHTHALENYL)DIAZENYL)-8-(2-(4-(2-PHENYLDIAZENYL)-7-SULFO-1-NAPHTHALENYL)DIAZENYL)-, SODIUM SALT (1:3)
Systematic Name English
Code System Code Type Description
FDA UNII
53J326549K
Created by admin on Sat Dec 16 10:53:33 GMT 2023 , Edited by admin on Sat Dec 16 10:53:33 GMT 2023
PRIMARY
ECHA (EC/EINECS)
229-035-1
Created by admin on Sat Dec 16 10:53:33 GMT 2023 , Edited by admin on Sat Dec 16 10:53:33 GMT 2023
PRIMARY
CAS
6406-87-7
Created by admin on Sat Dec 16 10:53:33 GMT 2023 , Edited by admin on Sat Dec 16 10:53:33 GMT 2023
PRIMARY