N-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]quinoline-2-carboxamide

Systemtic Name: N-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]quinoline-2-carboxamide Openeye Name: N-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]quinoline-2-carboxamide CAS Name: N-[2-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]ethyl]-2-quinolinecarboxamide IUPAC Name: N-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]quinoline-2-carboxamide Traditional Name: N-[2-[4-[3-(trifluoromethyl)phenyl]piperazino]ethyl]quinaldamide Formula: C23H23F3N4O MolecularWeight: 428.45013

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCNC(=O)C2=NC3=CC=CC=C3C=C2)C4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

C1CN(CCN1CCNC(=O)C2=NC3=CC=CC=C3C=C2)C4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C23H23F3N4O/c24-23(25,26)18-5-3-6-19(16-18)30-14-12-29(13-15-30)11-10-27-22(31)21-9-8-17-4-1-2-7-20(17)28-21/h1-9,16H,10-15H2,(H,27,31)