N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-4-(cyclopropylmethyl)-1-[(1-methyl-2-oxidanylidene-quinolin-7-yl)methyl]piperidine-4-carboxamide

Systemtic Name: N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-4-(cyclopropylmethyl)-1-[(1-methyl-2-oxidanylidene-quinolin-7-yl)methyl]piperidine-4-carboxamide Openeye Name: N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-4-(cyclopropylmethyl)-1-[(1-methyl-2-oxo-7-quinolyl)methyl]piperidine-4-carboxamide CAS Name: N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-4-(cyclopropylmethyl)-1-[(1-methyl-2-oxo-7-quinolinyl)methyl]-4-piperidinecarboxamide IUPAC Name: N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-4-(cyclopropylmethyl)-1-[(1-methyl-2-oxoquinolin-7-yl)methyl]piperidine-4-carboxamide Traditional Name: N-[3,5-bis(trifluoromethyl)benzyl]-4-(cyclopropylmethyl)-1-[(2-keto-1-methyl-7-quinolyl)methyl]isonipecotamide Formula: C30H31F6N3O2 MolecularWeight: 579.576459

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C=CC2=C1C=C(C=C2)CN3CCC(CC3)(CC4CC4)C(=O)NCC5=CC(=CC(=C5)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CN1C(=O)C=CC2=C1C=C(C=C2)CN3CCC(CC3)(CC4CC4)C(=O)NCC5=CC(=CC(=C5)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C30H31F6N3O2/c1-38-25-14-20(4-5-22(25)6-7-26(38)40)18-39-10-8-28(9-11-39,16-19-2-3-19)27(41)37-17-21-12-23(29(31,32)33)15-24(13-21)30(34,35)36/h4-7,12-15,19H,2-3,8-11,16-18H2,1H3,(H,37,41)