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

Details

Stereochemistry RACEMIC
Molecular Formula C22H27NO2
Molecular Weight 337.4553
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PIFENATE

SMILES

CCOC(=O)C(CC1CCCCN1)(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChIKey=KSIVTSFSGVVBJQ-UHFFFAOYSA-N
InChI=1S/C22H27NO2/c1-2-25-21(24)22(18-11-5-3-6-12-18,19-13-7-4-8-14-19)17-20-15-9-10-16-23-20/h3-8,11-14,20,23H,2,9-10,15-17H2,1H3

HIDE SMILES / InChI

Molecular Formula C22H27NO2
Molecular Weight 337.4553
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Substance Class Chemical
Created
by admin
on Sat Dec 16 17:58:23 GMT 2023
Edited
by admin
on Sat Dec 16 17:58:23 GMT 2023
Record UNII
STW31V60ZL
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PIFENATE
INN  
INN  
Official Name English
ETHYL .ALPHA.,.ALPHA.-DIPHENYL-2-PIPERIDINEPROPIONATE
Systematic Name English
pifenate [INN]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C241
Created by admin on Sat Dec 16 17:58:23 GMT 2023 , Edited by admin on Sat Dec 16 17:58:23 GMT 2023
Code System Code Type Description
FDA UNII
STW31V60ZL
Created by admin on Sat Dec 16 17:58:23 GMT 2023 , Edited by admin on Sat Dec 16 17:58:23 GMT 2023
PRIMARY
SMS_ID
100000081926
Created by admin on Sat Dec 16 17:58:23 GMT 2023 , Edited by admin on Sat Dec 16 17:58:23 GMT 2023
PRIMARY
EVMPD
SUB09828MIG
Created by admin on Sat Dec 16 17:58:23 GMT 2023 , Edited by admin on Sat Dec 16 17:58:23 GMT 2023
PRIMARY
NCI_THESAURUS
C75071
Created by admin on Sat Dec 16 17:58:23 GMT 2023 , Edited by admin on Sat Dec 16 17:58:23 GMT 2023
PRIMARY
PUBCHEM
3047844
Created by admin on Sat Dec 16 17:58:23 GMT 2023 , Edited by admin on Sat Dec 16 17:58:23 GMT 2023
PRIMARY
ChEMBL
CHEMBL2104725
Created by admin on Sat Dec 16 17:58:23 GMT 2023 , Edited by admin on Sat Dec 16 17:58:23 GMT 2023
PRIMARY
INN
2148
Created by admin on Sat Dec 16 17:58:23 GMT 2023 , Edited by admin on Sat Dec 16 17:58:23 GMT 2023
PRIMARY
CAS
15686-87-0
Created by admin on Sat Dec 16 17:58:23 GMT 2023 , Edited by admin on Sat Dec 16 17:58:23 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY