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

Systemtic Name: N-(3,4-dimethylphenyl)-1-[3-(trifluoromethyl)quinoxalin-2-yl]piperidine-4-carboxamide Openeye Name: N-(3,4-dimethylphenyl)-1-[3-(trifluoromethyl)quinoxalin-2-yl]piperidine-4-carboxamide CAS Name: N-(3,4-dimethylphenyl)-1-[3-(trifluoromethyl)-2-quinoxalinyl]-4-piperidinecarboxamide IUPAC Name: N-(3,4-dimethylphenyl)-1-[3-(trifluoromethyl)quinoxalin-2-yl]piperidine-4-carboxamide Traditional Name: N-(3,4-dimethylphenyl)-1-[3-(trifluoromethyl)quinoxalin-2-yl]isonipecotamide Formula: C23H23F3N4O MolecularWeight: 428.45013

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)C3=NC4=CC=CC=C4N=C3C(F)(F)F)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)C3=NC4=CC=CC=C4N=C3C(F)(F)F)C

InChI

InChI=1S/C23H23F3N4O/c1-14-7-8-17(13-15(14)2)27-22(31)16-9-11-30(12-10-16)21-20(23(24,25)26)28-18-5-3-4-6-19(18)29-21/h3-8,13,16H,9-12H2,1-2H3,(H,27,31)