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Details

Stereochemistry RACEMIC
Molecular Formula C22H25NO2
Molecular Weight 335.4394
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-(4,4-Diphenylbut-3-en-1-yl)piperidine-3-carboxylic acid

SMILES

OC(=O)C1CCCN(CCC=C(C2=CC=CC=C2)C3=CC=CC=C3)C1

InChI

InChIKey=TXQKSMSLZVKQBI-UHFFFAOYSA-N
InChI=1S/C22H25NO2/c24-22(25)20-13-7-15-23(17-20)16-8-14-21(18-9-3-1-4-10-18)19-11-5-2-6-12-19/h1-6,9-12,14,20H,7-8,13,15-17H2,(H,24,25)

HIDE SMILES / InChI

Molecular Formula C22H25NO2
Molecular Weight 335.4394
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
0.2 µM [IC50]
Substance Class Chemical
Created
by admin
on Mon Mar 31 21:59:40 GMT 2025
Edited
by admin
on Mon Mar 31 21:59:40 GMT 2025
Record UNII
HKU93AZP6B
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-(4,4-Diphenylbut-3-en-1-yl)piperidine-3-carboxylic acid
Systematic Name English
N-(4,4-Diphenyl-3-butenyl)nipecotic acid
Preferred Name English
SKF89976
Code English
d,l-SKF89976A
Common Name English
1-(4,4-Diphenyl-3-buten-1-yl)-3-piperidinecarboxylic acid
Systematic Name English
3-Piperidinecarboxylic acid, 1-(4,4-diphenyl-3-buten-1-yl)-
Systematic Name English
SKF-89976
Code English
Code System Code Type Description
EPA CompTox
DTXSID101005836
Created by admin on Mon Mar 31 21:59:40 GMT 2025 , Edited by admin on Mon Mar 31 21:59:40 GMT 2025
PRIMARY
CAS
85375-85-5
Created by admin on Mon Mar 31 21:59:40 GMT 2025 , Edited by admin on Mon Mar 31 21:59:40 GMT 2025
PRIMARY
FDA UNII
HKU93AZP6B
Created by admin on Mon Mar 31 21:59:40 GMT 2025 , Edited by admin on Mon Mar 31 21:59:40 GMT 2025
PRIMARY
WIKIPEDIA
SKF-89976A
Created by admin on Mon Mar 31 21:59:40 GMT 2025 , Edited by admin on Mon Mar 31 21:59:40 GMT 2025
PRIMARY
PUBCHEM
92409
Created by admin on Mon Mar 31 21:59:40 GMT 2025 , Edited by admin on Mon Mar 31 21:59:40 GMT 2025
PRIMARY