N-(4-methoxyphenyl)-1-[3-(trifluoromethyl)quinoxalin-2-yl]piperidine-4-carboxamide

Systemtic Name: N-(4-methoxyphenyl)-1-[3-(trifluoromethyl)quinoxalin-2-yl]piperidine-4-carboxamide Openeye Name: N-(4-methoxyphenyl)-1-[3-(trifluoromethyl)quinoxalin-2-yl]piperidine-4-carboxamide CAS Name: N-(4-methoxyphenyl)-1-[3-(trifluoromethyl)-2-quinoxalinyl]-4-piperidinecarboxamide IUPAC Name: N-(4-methoxyphenyl)-1-[3-(trifluoromethyl)quinoxalin-2-yl]piperidine-4-carboxamide Traditional Name: N-(4-methoxyphenyl)-1-[3-(trifluoromethyl)quinoxalin-2-yl]isonipecotamide Formula: C22H21F3N4O2 MolecularWeight: 430.42295

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2CCN(CC2)C3=NC4=CC=CC=C4N=C3C(F)(F)F

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C2CCN(CC2)C3=NC4=CC=CC=C4N=C3C(F)(F)F

InChI

InChI=1S/C22H21F3N4O2/c1-31-16-8-6-15(7-9-16)26-21(30)14-10-12-29(13-11-14)20-19(22(23,24)25)27-17-4-2-3-5-18(17)28-20/h2-9,14H,10-13H2,1H3,(H,26,30)