N,C-Fluorophenylbutyryl Haloperidol

Details

Stereochemistry	RACEMIC
Molecular Formula	C31H32ClF2NO3
Molecular Weight	540.04
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of N,C-Fluorophenylbutyryl Haloperidol

Structure Search

SMILES

OC1(CCN(CCC(CCCC(=O)C2=CC=C(F)C=C2)C(=O)C3=CC=C(F)C=C3)CC1)C4=CC=C(Cl)C=C4

InChI

InChIKey=XMHHCEIDXVFVEU-UHFFFAOYSA-N

InChI=1S/C31H32ClF2NO3/c32-26-10-8-25(9-11-26)31(38)17-20-35(21-18-31)19-16-23(30(37)24-6-14-28(34)15-7-24)2-1-3-29(36)22-4-12-27(33)13-5-22/h4-15,23,38H,1-3,16-21H2

HIDE SMILES / InChI

Molecular Formula	C31H32ClF2NO3
Molecular Weight	540.04
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 17:05:38 GMT 2025` Edited by `admin` on `Wed Apr 02 17:05:38 GMT 2025`
Record UNII	SBH8N48FGM
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

N,C-Fluorophenylbutyryl Haloperidol

Common Name

English

2-(1-(4-Fluorophenyl)butan-1-one)haloperidol

Preferred Name

English

2-(2-(4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl)ethyl)-1,6-bis(4-fluorophenyl)hexane-1,6-dione

Systematic Name

English

Code System Code Type Description

PUBCHEM

169440644

Created by admin on Wed Apr 02 17:05:38 GMT 2025 , Edited by admin on Wed Apr 02 17:05:38 GMT 2025

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CAS

2733217-31-5

Created by admin on Wed Apr 02 17:05:38 GMT 2025 , Edited by admin on Wed Apr 02 17:05:38 GMT 2025

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FDA UNII

SBH8N48FGM

Created by admin on Wed Apr 02 17:05:38 GMT 2025 , Edited by admin on Wed Apr 02 17:05:38 GMT 2025

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Related Record Type Details


					J6292F8L3D

HALOPERIDOL

PARENT -> IMPURITY

Amount: