2-cyclopropyl-N-[[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]methyl]-N-methyl-quinoline-4-carboxamide

Systemtic Name: 2-cyclopropyl-N-[[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]methyl]-N-methyl-quinoline-4-carboxamide Openeye Name: 2-cyclopropyl-N-[[1-[2-(4-fluorophenyl)ethyl]-4-piperidyl]methyl]-N-methyl-quinoline-4-carboxamide CAS Name: 2-cyclopropyl-N-[[1-[2-(4-fluorophenyl)ethyl]-4-piperidinyl]methyl]-N-methyl-4-quinolinecarboxamide IUPAC Name: 2-cyclopropyl-N-[[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]methyl]-N-methylquinoline-4-carboxamide Traditional Name: 2-cyclopropyl-N-[[1-[2-(4-fluorophenyl)ethyl]-4-piperidyl]methyl]-N-methyl-cinchoninamide Formula: C28H32FN3O MolecularWeight: 445.571583

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1CCN(CC1)CCC2=CC=C(C=C2)F)C(=O)C3=CC(=NC4=CC=CC=C43)C5CC5

Isomeric SMILES

CN(CC1CCN(CC1)CCC2=CC=C(C=C2)F)C(=O)C3=CC(=NC4=CC=CC=C43)C5CC5

InChI

InChI=1S/C28H32FN3O/c1-31(19-21-13-16-32(17-14-21)15-12-20-6-10-23(29)11-7-20)28(33)25-18-27(22-8-9-22)30-26-5-3-2-4-24(25)26/h2-7,10-11,18,21-22H,8-9,12-17,19H2,1H3