N-[1-[3,5-bis(trifluoromethyl)phenyl]carbonyl-2-(phenylmethyl)piperidin-4-yl]-4H-quinoline-1-carboxamide

Systemtic Name: N-[1-[3,5-bis(trifluoromethyl)phenyl]carbonyl-2-(phenylmethyl)piperidin-4-yl]-4H-quinoline-1-carboxamide Openeye Name: N-[2-benzyl-1-[3,5-bis(trifluoromethyl)benzoyl]-4-piperidyl]-4H-quinoline-1-carboxamide CAS Name: N-[1-[[3,5-bis(trifluoromethyl)phenyl]-oxomethyl]-2-(phenylmethyl)-4-piperidinyl]-4H-quinoline-1-carboxamide IUPAC Name: N-[2-benzyl-1-[3,5-bis(trifluoromethyl)benzoyl]piperidin-4-yl]-4H-quinoline-1-carboxamide Traditional Name: N-[2-benzyl-1-[3,5-bis(trifluoromethyl)benzoyl]-4-piperidyl]-4H-quinoline-1-carboxamide Formula: C31H27F6N3O2 MolecularWeight: 587.555399

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CC1NC(=O)N2C=CCC3=CC=CC=C32)CC4=CC=CC=C4)C(=O)C5=CC(=CC(=C5)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1CN(C(CC1NC(=O)N2C=CCC3=CC=CC=C32)CC4=CC=CC=C4)C(=O)C5=CC(=CC(=C5)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C31H27F6N3O2/c32-30(33,34)23-16-22(17-24(18-23)31(35,36)37)28(41)39-14-12-25(19-26(39)15-20-7-2-1-3-8-20)38-29(42)40-13-6-10-21-9-4-5-11-27(21)40/h1-9,11,13,16-18,25-26H,10,12,14-15,19H2,(H,38,42)