QUINACRINE MUSTARD DIHYDROCHLORIDE

Details

Stereochemistry	RACEMIC
Molecular Formula	C23H28Cl3N3O.2ClH
Molecular Weight	541.769
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of QUINACRINE MUSTARD DIHYDROCHLORIDE

Structure Search

SMILES

Cl.Cl.COC1=CC2=C(C=C1)N=C3C=C(Cl)C=CC3=C2NC(C)CCCN(CCCl)CCCl

InChI

InChIKey=JETDZFFCRPFPDH-UHFFFAOYSA-N

InChI=1S/C23H28Cl3N3O.2ClH/c1-16(4-3-11-29(12-9-24)13-10-25)27-23-19-7-5-17(26)14-22(19)28-21-8-6-18(30-2)15-20(21)23;;/h5-8,14-16H,3-4,9-13H2,1-2H3,(H,27,28);2*1H

HIDE SMILES / InChI

Molecular Formula	ClH
Molecular Weight	36.461
Charge	0
Count

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

Molecular Formula	C23H28Cl3N3O
Molecular Weight	468.847
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 11:04:50 UTC 2023` Edited by `admin` on `Sat Dec 16 11:04:50 UTC 2023`
Record UNII	RCB69HPY0X
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

QUINACRINE MUSTARD DIHYDROCHLORIDE

Common Name

English

NSC-3424

Code

English

1,4-PENTANEDIAMINE, N1,N1-BIS(2-CHLOROETHYL)-N4-(6-CHLORO-2-METHOXY-9-ACRIDINYL)-, HYDROCHLORIDE (1:2)

Systematic Name

English

Code System Code Type Description

FDA UNII

RCB69HPY0X