FP-21399

Details

Stereochemistry	ACHIRAL
Molecular Formula	C42H24Cl4N6O18S4.4Na
Molecular Weight	1262.7
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	2
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[Na+].[Na+].[Na+].[Na+].COC1=CC(\N=N\C2=C(O)C3=C(NC(=O)C4=C(Cl)C(Cl)=CC=C4)C=C(C=C3C=C2S([O-])(=O)=O)S([O-])(=O)=O)=C(OC)C=C1\N=N\C5=C(O)C6=C(C=C(C=C6NC(=O)C7=C(Cl)C=C(Cl)C=C7)S([O-])(=O)=O)C=C5S([O-])(=O)=O

InChI

InChIKey=JZGXIWOIOQUZFS-BEZIOABYSA-J

InChI=1S/C42H28Cl4N6O18S4.4Na/c1-69-30-16-27(50-52-38-33(74(66,67)68)11-18-9-21(72(60,61)62)14-29(35(18)40(38)54)48-42(56)23-4-3-5-24(44)36(23)46)31(70-2)15-26(30)49-51-37-32(73(63,64)65)10-17-8-20(71(57,58)59)13-28(34(17)39(37)53)47-41(55)22-7-6-19(43)12-25(22)45;;;;/h3-16,53-54H,1-2H3,(H,47,55)(H,48,56)(H,57,58,59)(H,60,61,62)(H,63,64,65)(H,66,67,68);;;;/q;4*+1/p-4/b51-49+,52-50+;;;;

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	C42H24Cl4N6O18S4
Molecular Weight	1170.741
Charge	-4
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	2
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:52:38 UTC 2023` Edited by `admin` on `Fri Dec 15 15:52:38 UTC 2023`
Record UNII	NZR4S1X98O
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

FP-21399

Common Name

English

5-(2,3-DICHLOROBENZOYLAMINO)-3-(4-(N'-(5-(2,4-DICHLOROBENZOYLAMINO)-4-OXO-3,4-DIHYDRO-2,7-DISULFONAPHTHALENE-3-YLIDENE)HYDRAZINO)-2,5-DIMETHOXYPHENYLHYDRAZINO)-4-OXO-3,4-DIHYDRONAPHTHALENE-2,7-DISULFONIC ACID TETRASODIUM

Common Name

English

Code System Code Type Description

CAS

170020-61-8

Created by admin on Fri Dec 15 15:52:38 UTC 2023 , Edited by admin on Fri Dec 15 15:52:38 UTC 2023

PRIMARY

FDA UNII

NZR4S1X98O

Created by admin on Fri Dec 15 15:52:38 UTC 2023 , Edited by admin on Fri Dec 15 15:52:38 UTC 2023

PRIMARY

Related Record Type Details


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FP-21399 FREE ACID

PARENT -> SALT/SOLVATE