5-Hydroxydomperidone

Details

Stereochemistry	ACHIRAL
Molecular Formula	C22H24ClN5O3
Molecular Weight	441.911
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OC1=CC2=C(C=C1)N(CCCN3CCC(CC3)N4C(=O)NC5=CC(Cl)=CC=C45)C(=O)N2

InChI

InChIKey=SWKZXSSZKVNAJG-UHFFFAOYSA-N

InChI=1S/C22H24ClN5O3/c23-14-2-4-20-17(12-14)25-22(31)28(20)15-6-10-26(11-7-15)8-1-9-27-19-5-3-16(29)13-18(19)24-21(27)30/h2-5,12-13,15,29H,1,6-11H2,(H,24,30)(H,25,31)

HIDE SMILES / InChI

Molecular Formula	C22H24ClN5O3
Molecular Weight	441.911
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 19:32:07 GMT 2023` Edited by `admin` on `Sat Dec 16 19:32:07 GMT 2023`
Record UNII	ZE6EAB6RGV
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

5-Hydroxydomperidone

Common Name

English

2H-Benzimidazol-2-one, 5-chloro-1-[1-[3-(2,3-dihydro-5-hydroxy-2-oxo-1H-benzimidazol-1-yl)propyl]-4-piperidinyl]-1,3-dihydro-

Systematic Name

English

Domperidone metabolite M3

Common Name

English

5-Chloro-1-[1-[3-(2,3-dihydro-5-hydroxy-2-oxo-1H-benzimidazol-1-yl)propyl]-4-piperidinyl]-1,3-dihydro-2H-benzimidazol-2-one

Systematic Name

English

Code System Code Type Description

FDA UNII

ZE6EAB6RGV

Created by admin on Sat Dec 16 19:32:07 GMT 2023 , Edited by admin on Sat Dec 16 19:32:07 GMT 2023

PRIMARY

EPA CompTox

DTXSID30231668

Created by admin on Sat Dec 16 19:32:07 GMT 2023 , Edited by admin on Sat Dec 16 19:32:07 GMT 2023

PRIMARY

CAS

82294-72-2

Created by admin on Sat Dec 16 19:32:07 GMT 2023 , Edited by admin on Sat Dec 16 19:32:07 GMT 2023

PRIMARY

PUBCHEM

158069

Created by admin on Sat Dec 16 19:32:07 GMT 2023 , Edited by admin on Sat Dec 16 19:32:07 GMT 2023

PRIMARY

Related Record Type Details


					5587267Z69

DOMPERIDONE

PARENT -> METABOLITE

Amount: