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

Systemtic Name: 8-fluoranyl-3-[[1-(oxan-4-yl)piperidin-4-yl]methyl]-2-phenyl-N-[(1S)-1-phenylpropyl]quinoline-4-carboxamide Openeye Name: 8-fluoro-2-phenyl-N-[(1S)-1-phenylpropyl]-3-[(1-tetrahydropyran-4-yl-4-piperidyl)methyl]quinoline-4-carboxamide CAS Name: 8-fluoro-3-[[1-(4-oxanyl)-4-piperidinyl]methyl]-2-phenyl-N-[(1S)-1-phenylpropyl]-4-quinolinecarboxamide IUPAC Name: 8-fluoro-3-[[1-(oxan-4-yl)piperidin-4-yl]methyl]-2-phenyl-N-[(1S)-1-phenylpropyl]quinoline-4-carboxamide Traditional Name: 8-fluoro-2-phenyl-N-[(1S)-1-phenylpropyl]-3-[(1-tetrahydropyran-4-yl-4-piperidyl)methyl]cinchoninamide Formula: C36H40FN3O2 MolecularWeight: 565.720103

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)NC(=O)C2=C3C=CC=C(C3=NC(=C2CC4CCN(CC4)C5CCOCC5)C6=CC=CC=C6)F

Isomeric SMILES

CC[C@@H](C1=CC=CC=C1)NC(=O)C2=C3C=CC=C(C3=NC(=C2CC4CCN(CC4)C5CCOCC5)C6=CC=CC=C6)F

InChI

InChI=1S/C36H40FN3O2/c1-2-32(26-10-5-3-6-11-26)38-36(41)33-29-14-9-15-31(37)35(29)39-34(27-12-7-4-8-13-27)30(33)24-25-16-20-40(21-17-25)28-18-22-42-23-19-28/h3-15,25,28,32H,2,16-24H2,1H3,(H,38,41)/t32-/m0/s1