1-(4-(3-(4-(6-FLUORO-1,2-BENZISOXAZOL-3-YL)-1-PIPERIDINYL)PROPOXY)-3-METHOXYPHENYL)-2-HYDROXYETHANONE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C24H27FN2O5
Molecular Weight	442.48
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1-(4-(3-(4-(6-FLUORO-1,2-BENZISOXAZOL-3-YL)-1-PIPERIDINYL)PROPOXY)-3-METHOXYPHENYL)-2-HYDROXYETHANONE

Structure Search

SMILES

COC1=CC(=CC=C1OCCCN2CCC(CC2)C3=NOC4=CC(F)=CC=C34)C(=O)CO

InChI

InChIKey=BGCPETUXPSZMBH-UHFFFAOYSA-N

InChI=1S/C24H27FN2O5/c1-30-23-13-17(20(29)15-28)3-6-21(23)31-12-2-9-27-10-7-16(8-11-27)24-19-5-4-18(25)14-22(19)32-26-24/h3-6,13-14,16,28H,2,7-12,15H2,1H3

HIDE SMILES / InChI

Molecular Formula	C24H27FN2O5
Molecular Weight	442.48
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 14:59:02 UTC 2023` Edited by `admin` on `Sat Dec 16 14:59:02 UTC 2023`
Record UNII	5D8MD4Z5EB
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1-(4-(3-(4-(6-FLUORO-1,2-BENZISOXAZOL-3-YL)-1-PIPERIDINYL)PROPOXY)-3-METHOXYPHENYL)-2-HYDROXYETHANONE

Systematic Name

English

ILOPERIDONE METABOLITE P94

Common Name

English

ETHANONE, 1-(4-(3-(4-(6-FLUORO-1,2-BENZISOXAZOL-3-YL)-1-PIPERIDINYL)PROPOXY)-3-METHOXYPHENYL)-2-HYDROXY-

Systematic Name

English

Code System Code Type Description

FDA UNII

5D8MD4Z5EB

Created by admin on Sat Dec 16 14:59:02 UTC 2023 , Edited by admin on Sat Dec 16 14:59:02 UTC 2023

PRIMARY

PUBCHEM

18467218

Created by admin on Sat Dec 16 14:59:02 UTC 2023 , Edited by admin on Sat Dec 16 14:59:02 UTC 2023

PRIMARY

CAS

170170-48-6

Created by admin on Sat Dec 16 14:59:02 UTC 2023 , Edited by admin on Sat Dec 16 14:59:02 UTC 2023

PRIMARY

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ILOPERIDONE

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