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

Details

Stereochemistry RACEMIC
Molecular Formula C16H22FNO
Molecular Weight 263.3504
Optical Activity ( + / - )
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-FLUORO-.ALPHA.-PHP

SMILES

CCCC(F)C(N1CCCC1)C(=O)C2=CC=CC=C2

InChI

InChIKey=RLLWOBFFFODJGO-UHFFFAOYSA-N
InChI=1S/C16H22FNO/c1-2-8-14(17)15(18-11-6-7-12-18)16(19)13-9-4-3-5-10-13/h3-5,9-10,14-15H,2,6-8,11-12H2,1H3

HIDE SMILES / InChI

Molecular Formula C16H22FNO
Molecular Weight 263.3504
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 19:00:57 GMT 2023
Edited
by admin
on Sat Dec 16 19:00:57 GMT 2023
Record UNII
9MY6P287BG
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-FLUORO-.ALPHA.-PHP
Common Name English
3-FLUORO-.ALPHA.-PYRROLIDINOHEXANOPHENONE
Systematic Name English
1-(3-FLUOROPHENYL)-2-(PYRROLIDIN-1-YL)HEXAN-1-ONE
Systematic Name English
Code System Code Type Description
FDA UNII
9MY6P287BG
Created by admin on Sat Dec 16 19:00:57 GMT 2023 , Edited by admin on Sat Dec 16 19:00:57 GMT 2023
PRIMARY
PUBCHEM
165412120
Created by admin on Sat Dec 16 19:00:57 GMT 2023 , Edited by admin on Sat Dec 16 19:00:57 GMT 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT
Related Record Type Details
ACTIVE MOIETY