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

Systemtic Name: N-(3-chlorophenyl)-1-[3-(trifluoromethyl)quinoxalin-2-yl]piperidine-4-carboxamide Openeye Name: N-(3-chlorophenyl)-1-[3-(trifluoromethyl)quinoxalin-2-yl]piperidine-4-carboxamide CAS Name: N-(3-chlorophenyl)-1-[3-(trifluoromethyl)-2-quinoxalinyl]-4-piperidinecarboxamide IUPAC Name: N-(3-chlorophenyl)-1-[3-(trifluoromethyl)quinoxalin-2-yl]piperidine-4-carboxamide Traditional Name: N-(3-chlorophenyl)-1-[3-(trifluoromethyl)quinoxalin-2-yl]isonipecotamide Formula: C21H18ClF3N4O MolecularWeight: 434.84203

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC(=CC=C2)Cl)C3=NC4=CC=CC=C4N=C3C(F)(F)F

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC(=CC=C2)Cl)C3=NC4=CC=CC=C4N=C3C(F)(F)F

InChI

InChI=1S/C21H18ClF3N4O/c22-14-4-3-5-15(12-14)26-20(30)13-8-10-29(11-9-13)19-18(21(23,24)25)27-16-6-1-2-7-17(16)28-19/h1-7,12-13H,8-11H2,(H,26,30)