2-phenyl-3-[(4-phenylpiperidin-1-yl)methyl]-N-[(1S)-1-phenylpropyl]quinoline-4-carboxamide

Systemtic Name: 2-phenyl-3-[(4-phenylpiperidin-1-yl)methyl]-N-[(1S)-1-phenylpropyl]quinoline-4-carboxamide Openeye Name: 2-phenyl-3-[(4-phenyl-1-piperidyl)methyl]-N-[(1S)-1-phenylpropyl]quinoline-4-carboxamide CAS Name: 2-phenyl-3-[(4-phenyl-1-piperidinyl)methyl]-N-[(1S)-1-phenylpropyl]-4-quinolinecarboxamide IUPAC Name: 2-phenyl-3-[(4-phenylpiperidin-1-yl)methyl]-N-[(1S)-1-phenylpropyl]quinoline-4-carboxamide Traditional Name: 2-phenyl-3-[(4-phenylpiperidino)methyl]-N-[(1S)-1-phenylpropyl]cinchoninamide Formula: C37H37N3O MolecularWeight: 539.70918

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)NC(=O)C2=C(C(=NC3=CC=CC=C32)C4=CC=CC=C4)CN5CCC(CC5)C6=CC=CC=C6

Isomeric SMILES

CC[C@@H](C1=CC=CC=C1)NC(=O)C2=C(C(=NC3=CC=CC=C32)C4=CC=CC=C4)CN5CCC(CC5)C6=CC=CC=C6

InChI

InChI=1S/C37H37N3O/c1-2-33(29-16-8-4-9-17-29)39-37(41)35-31-20-12-13-21-34(31)38-36(30-18-10-5-11-19-30)32(35)26-40-24-22-28(23-25-40)27-14-6-3-7-15-27/h3-21,28,33H,2,22-26H2,1H3,(H,39,41)/t33-/m0/s1