8-fluoranyl-2-phenyl-N-[(1S)-1-phenylpropyl]-3-(piperidin-4-ylmethyl)quinoline-4-carboxamide

Systemtic Name: 8-fluoranyl-2-phenyl-N-[(1S)-1-phenylpropyl]-3-(piperidin-4-ylmethyl)quinoline-4-carboxamide Openeye Name: 8-fluoro-2-phenyl-N-[(1S)-1-phenylpropyl]-3-(4-piperidylmethyl)quinoline-4-carboxamide CAS Name: 8-fluoro-2-phenyl-N-[(1S)-1-phenylpropyl]-3-(4-piperidinylmethyl)-4-quinolinecarboxamide IUPAC Name: 8-fluoro-2-phenyl-N-[(1S)-1-phenylpropyl]-3-(piperidin-4-ylmethyl)quinoline-4-carboxamide Traditional Name: 8-fluoro-2-phenyl-N-[(1S)-1-phenylpropyl]-3-(4-piperidylmethyl)cinchoninamide Formula: C31H32FN3O MolecularWeight: 481.603683

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)NC(=O)C2=C3C=CC=C(C3=NC(=C2CC4CCNCC4)C5=CC=CC=C5)F

Isomeric SMILES

CC[C@@H](C1=CC=CC=C1)NC(=O)C2=C3C=CC=C(C3=NC(=C2CC4CCNCC4)C5=CC=CC=C5)F

InChI

InChI=1S/C31H32FN3O/c1-2-27(22-10-5-3-6-11-22)34-31(36)28-24-14-9-15-26(32)30(24)35-29(23-12-7-4-8-13-23)25(28)20-21-16-18-33-19-17-21/h3-15,21,27,33H,2,16-20H2,1H3,(H,34,36)/t27-/m0/s1