9,10-Anthracenedione, 1,4-diamino-2-chloro-3-(2-phenoxyethoxy)-

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C22H17ClN2O4
Molecular Weight	408.834
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 9,10-Anthracenedione, 1,4-diamino-2-chloro-3-(2-phenoxyethoxy)-

Structure Search

SMILES

NC1=C2C(=O)C3=C(C=CC=C3)C(=O)C2=C(N)C(OCCOC4=CC=CC=C4)=C1Cl

InChI

InChIKey=ZRPSVURUZDPMCA-UHFFFAOYSA-N

InChI=1S/C22H17ClN2O4/c23-17-18(24)15-16(21(27)14-9-5-4-8-13(14)20(15)26)19(25)22(17)29-11-10-28-12-6-2-1-3-7-12/h1-9H,10-11,24-25H2

HIDE SMILES / InChI

Molecular Formula	C22H17ClN2O4
Molecular Weight	408.834
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 `Sat Dec 16 20:07:13 GMT 2023` Edited by `admin` on `Sat Dec 16 20:07:13 GMT 2023`
Record UNII	4WU8ACQ98V
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

9,10-Anthracenedione, 1,4-diamino-2-chloro-3-(2-phenoxyethoxy)-

Systematic Name

English

1,4-Diamino-2-chloro-3-(2-phenoxyethoxy)-9,10-anthracenedione

Systematic Name

English

Code System Code Type Description

CAS

41312-86-1

Created by admin on Sat Dec 16 20:07:13 GMT 2023 , Edited by admin on Sat Dec 16 20:07:13 GMT 2023

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PUBCHEM

170490

Created by admin on Sat Dec 16 20:07:13 GMT 2023 , Edited by admin on Sat Dec 16 20:07:13 GMT 2023

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EPA CompTox

DTXSID4068298

Created by admin on Sat Dec 16 20:07:13 GMT 2023 , Edited by admin on Sat Dec 16 20:07:13 GMT 2023

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ECHA (EC/EINECS)

255-309-5

Created by admin on Sat Dec 16 20:07:13 GMT 2023 , Edited by admin on Sat Dec 16 20:07:13 GMT 2023

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FDA UNII

4WU8ACQ98V

Created by admin on Sat Dec 16 20:07:13 GMT 2023 , Edited by admin on Sat Dec 16 20:07:13 GMT 2023

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