U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C17H24FNO.ClH
Molecular Weight 313.838
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of R-4457 HYDROCHLORIDE

SMILES

Cl.CC1(C)CCN(CCCC(=O)C2=CC=C(F)C=C2)CC1

InChI

InChIKey=ZYAIASSKMDDACW-UHFFFAOYSA-N
InChI=1S/C17H24FNO.ClH/c1-17(2)9-12-19(13-10-17)11-3-4-16(20)14-5-7-15(18)8-6-14;/h5-8H,3-4,9-13H2,1-2H3;1H

HIDE SMILES / InChI

Approval Year

Name Type Language
WY-6123 HYDROCHLORIDE
Preferred Name English
R-4457 HYDROCHLORIDE
Common Name English
1-BUTANONE, 4-(4,4-DIMETHYL-1-PIPERIDINYL)-1-(4-FLUOROPHENYL)-, HYDROCHLORIDE (1:1)
Systematic Name English
4'-FLUORO-4-(4,4-DIMETHYLPIPERIDINO)BUTYROPHENONE HYDROCHLORIDE
Systematic Name English
Code System Code Type Description
CAS
1226-95-5
Created by admin on Mon Mar 31 17:47:08 GMT 2025 , Edited by admin on Mon Mar 31 17:47:08 GMT 2025
PRIMARY
PUBCHEM
23617444
Created by admin on Mon Mar 31 17:47:08 GMT 2025 , Edited by admin on Mon Mar 31 17:47:08 GMT 2025
PRIMARY
FDA UNII
QVH13JPT07
Created by admin on Mon Mar 31 17:47:08 GMT 2025 , Edited by admin on Mon Mar 31 17:47:08 GMT 2025
PRIMARY