DISODIUM 5-(BENZOYLAMINO)-3-((2-(4-CYCLOHEXYLPHENOXY)PHENYL)AZO)-4-HYDROXYNAPHTHALENE-2,7-DISULFONATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C35H29N3O9S2.2Na
Molecular Weight	745.729
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of DISODIUM 5-(BENZOYLAMINO)-3-((2-(4-CYCLOHEXYLPHENOXY)PHENYL)AZO)-4-HYDROXYNAPHTHALENE-2,7-DISULFONATE

Structure Search

SMILES

[Na+].[Na+].OC1=C(\N=N\C2=CC=CC=C2OC3=CC=C(C=C3)C4CCCCC4)C(=CC5=C1C(NC(=O)C6=CC=CC=C6)=CC(=C5)S([O-])(=O)=O)S([O-])(=O)=O

InChI

InChIKey=CZQNYFSFABWDRS-XPPIURIRSA-L

InChI=1S/C35H31N3O9S2.2Na/c39-34-32-25(19-27(48(41,42)43)21-29(32)36-35(40)24-11-5-2-6-12-24)20-31(49(44,45)46)33(34)38-37-28-13-7-8-14-30(28)47-26-17-15-23(16-18-26)22-9-3-1-4-10-22;;/h2,5-8,11-22,39H,1,3-4,9-10H2,(H,36,40)(H,41,42,43)(H,44,45,46);;/q;2*+1/p-2/b38-37+;;

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	C35H29N3O9S2
Molecular Weight	699.749
Charge	-2
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 08:28:00 GMT 2023` Edited by `admin` on `Sat Dec 16 08:28:00 GMT 2023`
Record UNII	V0NL0JX03M
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DISODIUM 5-(BENZOYLAMINO)-3-((2-(4-CYCLOHEXYLPHENOXY)PHENYL)AZO)-4-HYDROXYNAPHTHALENE-2,7-DISULFONATE

Common Name

English

J319.247D

Code

English

5-(BENZOYLAMINO)-3-((2-(4-CYCLOHEXYLPHENOXY)PHENYL)AZO)-4-HYDROXY-2,7-NAPHTHALENEDISULFONIC ACID DISODIUM SALT

Systematic Name

English

2,7-NAPHTHALENEDISULFONIC ACID, 5-(BENZOYLAMINO)-3-((2-(4-CYCLOHEXYLPHENOXY)PHENYL)AZO)-4-HYDROXY-, DISODIUM SALT

Common Name

English

2,7-NAPHTHALENEDISULFONIC ACID, 5-(BENZOYLAMINO)-3-(2-(2-(4-CYCLOHEXYLPHENOXY)PHENYL)DIAZENYL)-4-HYDROXY-, SODIUM SALT (1:2)

Systematic Name

English

Code System Code Type Description

CAS

79234-36-9

Created by admin on Sat Dec 16 08:28:00 GMT 2023 , Edited by admin on Sat Dec 16 08:28:00 GMT 2023

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ECHA (EC/EINECS)

279-117-6

Created by admin on Sat Dec 16 08:28:00 GMT 2023 , Edited by admin on Sat Dec 16 08:28:00 GMT 2023

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FDA UNII

V0NL0JX03M

Created by admin on Sat Dec 16 08:28:00 GMT 2023 , Edited by admin on Sat Dec 16 08:28:00 GMT 2023

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EPA CompTox

DTXSID7041382

Created by admin on Sat Dec 16 08:28:00 GMT 2023 , Edited by admin on Sat Dec 16 08:28:00 GMT 2023

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