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

Systemtic Name: N-[1-[3,5-bis(trifluoromethyl)phenyl]carbonyl-2-[(4-chlorophenyl)methyl]piperidin-4-yl]quinoline-4-carboxamide Openeye Name: N-[1-[3,5-bis(trifluoromethyl)benzoyl]-2-[(4-chlorophenyl)methyl]-4-piperidyl]quinoline-4-carboxamide CAS Name: N-[1-[[3,5-bis(trifluoromethyl)phenyl]-oxomethyl]-2-[(4-chlorophenyl)methyl]-4-piperidinyl]-4-quinolinecarboxamide IUPAC Name: N-[1-[3,5-bis(trifluoromethyl)benzoyl]-2-[(4-chlorophenyl)methyl]piperidin-4-yl]quinoline-4-carboxamide Traditional Name: N-[1-[3,5-bis(trifluoromethyl)benzoyl]-2-(4-chlorobenzyl)-4-piperidyl]cinchoninamide Formula: C31H24ClF6N3O2 MolecularWeight: 619.984579

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CC1NC(=O)C2=CC=NC3=CC=CC=C23)CC4=CC=C(C=C4)Cl)C(=O)C5=CC(=CC(=C5)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1CN(C(CC1NC(=O)C2=CC=NC3=CC=CC=C23)CC4=CC=C(C=C4)Cl)C(=O)C5=CC(=CC(=C5)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C31H24ClF6N3O2/c32-22-7-5-18(6-8-22)13-24-17-23(40-28(42)26-9-11-39-27-4-2-1-3-25(26)27)10-12-41(24)29(43)19-14-20(30(33,34)35)16-21(15-19)31(36,37)38/h1-9,11,14-16,23-24H,10,12-13,17H2,(H,40,42)