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

Details

Stereochemistry ACHIRAL
Molecular Formula C21H23ClFNO2
Molecular Weight 375.864
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-(4-(4-CHLOROPHENYL)-4-HYDROXYPIPERIDIN-1-YL)-1-(2-FLUOROPHENYL)BUTAN-1-ONE

SMILES

OC1(CCN(CCCC(=O)C2=CC=CC=C2F)CC1)C3=CC=C(Cl)C=C3

InChI

InChIKey=URVMQMKGIVIILI-UHFFFAOYSA-N
InChI=1S/C21H23ClFNO2/c22-17-9-7-16(8-10-17)21(26)11-14-24(15-12-21)13-3-6-20(25)18-4-1-2-5-19(18)23/h1-2,4-5,7-10,26H,3,6,11-15H2

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
4-(4-(4-CHLOROPHENYL)-4-HYDROXYPIPERIDIN-1-YL)-1-(2-FLUOROPHENYL)BUTAN-1-ONE
Systematic Name English
HALOPERIDOL IMPURITY B [EP IMPURITY]
Common Name English
HALOPERIDOL RELATED COMPOUND B [USP IMPURITY]
Common Name English
HALOPERIDOL RELATED COMPOUND B [USP-RS]
Common Name English
1-BUTANONE, 4-(4-(4-CHLOROPHENYL)-4-HYDROXY-1-PIPERIDINYL)-1-(2-FLUOROPHENYL)-
Systematic Name English
Code System Code Type Description
CAS
1391052-53-1
Created by admin on Sat Dec 16 08:41:18 GMT 2023 , Edited by admin on Sat Dec 16 08:41:18 GMT 2023
PRIMARY
RS_ITEM_NUM
1303024
Created by admin on Sat Dec 16 08:41:18 GMT 2023 , Edited by admin on Sat Dec 16 08:41:18 GMT 2023
PRIMARY
PUBCHEM
71315272
Created by admin on Sat Dec 16 08:41:18 GMT 2023 , Edited by admin on Sat Dec 16 08:41:18 GMT 2023
PRIMARY
EPA CompTox
DTXSID70160908
Created by admin on Sat Dec 16 08:41:18 GMT 2023 , Edited by admin on Sat Dec 16 08:41:18 GMT 2023
PRIMARY
FDA UNII
6ZQO8KXL92
Created by admin on Sat Dec 16 08:41:18 GMT 2023 , Edited by admin on Sat Dec 16 08:41:18 GMT 2023
PRIMARY
NIH
NCATS
PRIVACY ACT
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
For language access assistance, contact the NCATS Public Information Officer
National Center for Advancing Translational Sciences (NCATS),
6701 Democracy Boulevard, Bethesda MD 20892-4874 • 301-594-8966