N-(3-fluoranyl-4-morpholin-4-yl-phenyl)-N-(phenylmethyl)-1-(quinolin-2-ylmethyl)piperidine-4-carboxamide

Systemtic Name: N-(3-fluoranyl-4-morpholin-4-yl-phenyl)-N-(phenylmethyl)-1-(quinolin-2-ylmethyl)piperidine-4-carboxamide Openeye Name: N-benzyl-N-(3-fluoro-4-morpholino-phenyl)-1-(2-quinolylmethyl)piperidine-4-carboxamide CAS Name: N-[3-fluoro-4-(4-morpholinyl)phenyl]-N-(phenylmethyl)-1-(2-quinolinylmethyl)-4-piperidinecarboxamide IUPAC Name: N-benzyl-N-(3-fluoro-4-morpholin-4-ylphenyl)-1-(quinolin-2-ylmethyl)piperidine-4-carboxamide Traditional Name: N-benzyl-N-(3-fluoro-4-morpholino-phenyl)-1-(2-quinolylmethyl)isonipecotamide Formula: C33H35FN4O2 MolecularWeight: 538.655003

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N(CC2=CC=CC=C2)C3=CC(=C(C=C3)N4CCOCC4)F)CC5=NC6=CC=CC=C6C=C5

Isomeric SMILES

C1CN(CCC1C(=O)N(CC2=CC=CC=C2)C3=CC(=C(C=C3)N4CCOCC4)F)CC5=NC6=CC=CC=C6C=C5

InChI

InChI=1S/C33H35FN4O2/c34-30-22-29(12-13-32(30)37-18-20-40-21-19-37)38(23-25-6-2-1-3-7-25)33(39)27-14-16-36(17-15-27)24-28-11-10-26-8-4-5-9-31(26)35-28/h1-13,22,27H,14-21,23-24H2