DIRECT YELLOW 27

Details

Stereochemistry	RACEMIC
Molecular Formula	C25H20N4O9S3.2Na
Molecular Weight	662.622
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[Na+].[Na+].COC1=CC=CC=C1NC(=O)C(\N=N\C2=C(C=C(C=C2)C3=NC4=C(S3)C(=C(C)C=C4)S([O-])(=O)=O)S([O-])(=O)=O)C(C)=O

InChI

InChIKey=WLDNGJFRVWQASY-NTDCDQSISA-L

InChI=1S/C25H22N4O9S3.2Na/c1-13-8-10-18-22(23(13)41(35,36)37)39-25(27-18)15-9-11-17(20(12-15)40(32,33)34)28-29-21(14(2)30)24(31)26-16-6-4-5-7-19(16)38-3;;/h4-12,21H,1-3H3,(H,26,31)(H,32,33,34)(H,35,36,37);;/q;2*+1/p-2/b29-28+;;

HIDE SMILES / InChI

Molecular Formula	C25H20N4O9S3
Molecular Weight	616.643
Charge	-2
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	1
Optical Activity	( + / - )

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

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 09:47:48 GMT 2023` Edited by `admin` on `Sat Dec 16 09:47:48 GMT 2023`
Record UNII	N71N0J89ZH
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DIRECT YELLOW 27

Common Name

English

C.I. DIRECT YELLOW 27, DISODIUM SALT

Common Name

English

7-BENZOTHIAZOLESULFONIC ACID, 2-(4-((1-(((2-METHOXYPHENYL)AMINO)CARBONYL)-2-OXOPROPYL)AZO)-3-SULFOPHENYL)-6-METHYL-, DISODIUM SALT

Systematic Name

English

C.I. DIRECT YELLOW 27

Common Name

English

NSC-326243

Code

English

CI DIRECT YELLOW 27, DISODIUM SALT

Common Name

English

CI DIRECT YELLOW 27

Common Name

English

C.I. 13950

Common Name

English

NSC-326637

Code

English

7-BENZOTHIAZOLESULFONIC ACID, 2-(4-(2-(1-(((2-METHOXYPHENYL)AMINO)CARBONYL)-2-OXOPROPYL)DIAZENYL)-3-SULFOPHENYL)-6-METHYL-, SODIUM SALT (1:2)

Systematic Name

English

CI 13950

Common Name

English

Code System Code Type Description

CAS

10190-68-8