(4aR,8aS)-1-[2-(3-fluorophenyl)ethyl]-6-(pyridin-2-ylmethyl)-4,4a,5,7,8,8a-hexahydro-3H-1,6-naphthyridin-2-one

Systemtic Name: (4aR,8aS)-1-[2-(3-fluorophenyl)ethyl]-6-(pyridin-2-ylmethyl)-4,4a,5,7,8,8a-hexahydro-3H-1,6-naphthyridin-2-one Openeye Name: (4aR,8aS)-1-[2-(3-fluorophenyl)ethyl]-6-(2-pyridylmethyl)-4,4a,5,7,8,8a-hexahydro-3H-1,6-naphthyridin-2-one CAS Name: (4aR,8aS)-1-[2-(3-fluorophenyl)ethyl]-6-(2-pyridinylmethyl)-4,4a,5,7,8,8a-hexahydro-3H-1,6-naphthyridin-2-one IUPAC Name: (4aR,8aS)-1-[2-(3-fluorophenyl)ethyl]-6-(pyridin-2-ylmethyl)-4,4a,5,7,8,8a-hexahydro-3H-1,6-naphthyridin-2-one Traditional Name: (4aR,8aS)-1-[2-(3-fluorophenyl)ethyl]-6-(2-pyridylmethyl)-4,4a,5,7,8,8a-hexahydro-3H-1,6-naphthyridin-2-one Formula: C22H26FN3O MolecularWeight: 367.459743

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C2C1CN(CC2)CC3=CC=CC=N3)CCC4=CC(=CC=C4)F

Isomeric SMILES

C1CC(=O)N([C@@H]2[C@H]1CN(CC2)CC3=CC=CC=N3)CCC4=CC(=CC=C4)F

InChI

InChI=1S/C22H26FN3O/c23-19-5-3-4-17(14-19)9-13-26-21-10-12-25(15-18(21)7-8-22(26)27)16-20-6-1-2-11-24-20/h1-6,11,14,18,21H,7-10,12-13,15-16H2/t18-,21+/m1/s1