Trazodone N-oxide hydrochloride

Details

Stereochemistry	ACHIRAL
Molecular Formula	C19H22ClN5O2.ClH
Molecular Weight	424.324
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Trazodone N-oxide hydrochloride

Structure Search

SMILES

Cl.[O-][N+]3(CCCN1N=C2C=CC=CN2C1=O)CCN(CC3)C4=CC(Cl)=CC=C4

InChI

InChIKey=OJHQPLQLZLMMEU-UHFFFAOYSA-N

InChI=1S/C19H22ClN5O2.ClH/c20-16-5-3-6-17(15-16)22-10-13-25(27,14-11-22)12-4-9-24-19(26)23-8-2-1-7-18(23)21-24;/h1-3,5-8,15H,4,9-14H2;1H

HIDE SMILES / InChI

Molecular Formula	C19H22ClN5O2
Molecular Weight	387.863
Charge	0
Count

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

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

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 20:10:07 UTC 2023` Edited by `admin` on `Sat Dec 16 20:10:07 UTC 2023`
Record UNII	BQL6QA3XC4
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Trazodone N-oxide hydrochloride

Common Name

English

4-(3-chlorophenyl)-1-(3-{3-oxo-2H,3H-[1,2,4]triazolo[4,3-a]pyridin-2-yl}propyl)piperazin-1-ium-1-olate hydrochloride

Systematic Name

English

2-[3-[4-(3-chlorophenyl)-1-oxidopiperazin-1-ium-1-yl]propyl]-[1,2,4]triazolo[4,5-a]pyridin-3-one hydrochloride

Systematic Name

English

1,2,4-Triazolo[4,3-a]pyridin-3(2H)-one, 2-[3-[4-(3-chlorophenyl)-1-oxido-1-piperazinyl]propyl]-, hydrochloride (1:1)

Systematic Name

English

1,2,4-Triazolo[4,3-a]pyridin-3(2H)-one, 2-[3-[4-(3-chlorophenyl)-1-oxido-1-piperazinyl]propyl]-, monohydrochloride

Systematic Name

English

1,2,4-Triazolo[4,3-a]pyridin-3(2H)-one, 2-[3-[4-(3-chlorophenyl)-1-piperazinyl]propyl]-, N-oxide, monohydrochloride

Systematic Name

English

Code System Code Type Description

FDA UNII

BQL6QA3XC4

Created by admin on Sat Dec 16 20:10:07 UTC 2023 , Edited by admin on Sat Dec 16 20:10:07 UTC 2023

PRIMARY

PUBCHEM

129318551

Created by admin on Sat Dec 16 20:10:07 UTC 2023 , Edited by admin on Sat Dec 16 20:10:07 UTC 2023

PRIMARY

CAS

55290-66-9

Created by admin on Sat Dec 16 20:10:07 UTC 2023 , Edited by admin on Sat Dec 16 20:10:07 UTC 2023

PRIMARY

Related Record Type Details


					FNV4RP0XXB

TRAZODONE N-OXIDE

PARENT -> SALT/SOLVATE

Amount: