2-(4-methylphenyl)-N-[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]quinoline-4-carboxamide

Systemtic Name: 2-(4-methylphenyl)-N-[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]quinoline-4-carboxamide Openeye Name: N-[2-(1-piperidyl)-5-(trifluoromethyl)phenyl]-2-(p-tolyl)quinoline-4-carboxamide CAS Name: 2-(4-methylphenyl)-N-[2-(1-piperidinyl)-5-(trifluoromethyl)phenyl]-4-quinolinecarboxamide IUPAC Name: 2-(4-methylphenyl)-N-[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]quinoline-4-carboxamide Traditional Name: N-[2-piperidino-5-(trifluoromethyl)phenyl]-2-(p-tolyl)cinchoninamide Formula: C29H26F3N3O MolecularWeight: 489.53145

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C=CC(=C4)C(F)(F)F)N5CCCCC5

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C=CC(=C4)C(F)(F)F)N5CCCCC5

InChI

InChI=1S/C29H26F3N3O/c1-19-9-11-20(12-10-19)25-18-23(22-7-3-4-8-24(22)33-25)28(36)34-26-17-21(29(30,31)32)13-14-27(26)35-15-5-2-6-16-35/h3-4,7-14,17-18H,2,5-6,15-16H2,1H3,(H,34,36)