BANOXANTRONE DIHYDROCHLORIDE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C22H28N4O6.2ClH
Molecular Weight	517.403
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of BANOXANTRONE DIHYDROCHLORIDE

Structure Search

SMILES

Cl.Cl.C[N+](C)([O-])CCNC1=CC=C(NCC[N+](C)(C)[O-])C2=C1C(=O)C3=C(O)C=CC(O)=C3C2=O

InChI

InChIKey=SBWCPHUXRZRTDP-UHFFFAOYSA-N

InChI=1S/C22H28N4O6.2ClH/c1-25(2,31)11-9-23-13-5-6-14(24-10-12-26(3,4)32)18-17(13)21(29)19-15(27)7-8-16(28)20(19)22(18)30;;/h5-8,23-24,27-28H,9-12H2,1-4H3;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	C22H28N4O6
Molecular Weight	444.4809
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:35:43 UTC 2023` Edited by `admin` on `Fri Dec 15 15:35:43 UTC 2023`
Record UNII	658876KMFP
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

BANOXANTRONE DIHYDROCHLORIDE

Common Name

English

1,4-BIS((2-(DIMETHYLAMINO)ETHYL)AMINO)-5,8-DIHYDROXYANTHRACENE-9,10-DIONE BIS-N-OXIDE HYDROCHLORIDE

Systematic Name

English

1,4-BIS((2-(DIMETHYLNITRORYL)ETHYL)AMINO)-5,8-DIHYDROXYANTHRA-9,10-QUINONE DIHYDROCHLORIDE

Systematic Name

English

Code System Code Type Description

MESH

C094428