WR-27653 NAPHTHALENE-1,5-DISULFONATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C20H36BrN3O2.C10H8O6S2
Molecular Weight	718.72
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of WR-27653 NAPHTHALENE-1,5-DISULFONATE

Structure Search

SMILES

OS(=O)(=O)C1=CC=CC2=C(C=CC=C12)S(O)(=O)=O.CCN(CC)CCN(CCN(CC)CC)C3=C(Br)C=C(OC)C(OC)=C3

InChI

InChIKey=NPZKARHWZJRMNN-UHFFFAOYSA-N

InChI=1S/C20H36BrN3O2.C10H8O6S2/c1-7-22(8-2)11-13-24(14-12-23(9-3)10-4)18-16-20(26-6)19(25-5)15-17(18)21;11-17(12,13)9-5-1-3-7-8(9)4-2-6-10(7)18(14,15)16/h15-16H,7-14H2,1-6H3;1-6H,(H,11,12,13)(H,14,15,16)

HIDE SMILES / InChI

Molecular Formula	C10H8O6S2
Molecular Weight	288.297
Charge	0
Count

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

Molecular Formula	C20H36BrN3O2
Molecular Weight	430.423
Charge	0
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 `Wed Apr 02 04:21:14 GMT 2025` Edited by `admin` on `Wed Apr 02 04:21:14 GMT 2025`
Record UNII	W9J3OQ9CPF
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

1,5-NAPHTHALENEDISULFONIC ACID, COMPD. WITH N1-(2-BROMO-4,5-DIMETHOXYPHENYL)-N1-(2-(DIETHYLAMINO)ETHYL)-N2,N2-DIETHYL-1,2-ETHANEDIAMINE (1:1)

Preferred Name

English

WR-27653 NAPHTHALENE-1,5-DISULFONATE

Code

English

Code System Code Type Description

CAS

16938-69-5

Created by admin on Wed Apr 02 04:21:14 GMT 2025 , Edited by admin on Wed Apr 02 04:21:14 GMT 2025

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PUBCHEM

133082861

Created by admin on Wed Apr 02 04:21:14 GMT 2025 , Edited by admin on Wed Apr 02 04:21:14 GMT 2025

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FDA UNII

W9J3OQ9CPF

Created by admin on Wed Apr 02 04:21:14 GMT 2025 , Edited by admin on Wed Apr 02 04:21:14 GMT 2025

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