3-[[1-[2-(1-benzofuran-2-yl)ethyl]azepan-3-yl]methyl]-7,8-dimethyl-2,5-dihydro-1H-3-benzazepin-4-one

Systemtic Name: 3-[[1-[2-(1-benzofuran-2-yl)ethyl]azepan-3-yl]methyl]-7,8-dimethyl-2,5-dihydro-1H-3-benzazepin-4-one Openeye Name: 3-[[1-[2-(benzofuran-2-yl)ethyl]azepan-3-yl]methyl]-7,8-dimethyl-2,5-dihydro-1H-3-benzazepin-4-one CAS Name: 3-[[1-[2-(2-benzofuranyl)ethyl]-3-azepanyl]methyl]-7,8-dimethyl-2,5-dihydro-1H-3-benzazepin-4-one IUPAC Name: 3-[[1-[2-(1-benzofuran-2-yl)ethyl]azepan-3-yl]methyl]-7,8-dimethyl-2,5-dihydro-1H-3-benzazepin-4-one Traditional Name: 3-[[1-[2-(benzofuran-2-yl)ethyl]azepan-3-yl]methyl]-7,8-dimethyl-2,5-dihydro-1H-3-benzazepin-4-one Formula: C29H36N2O2 MolecularWeight: 444.60834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2CC(=O)N(CCC2=C1)CC3CCCCN(C3)CCC4=CC5=CC=CC=C5O4)C

Isomeric SMILES

CC1=C(C=C2CC(=O)N(CCC2=C1)CC3CCCCN(C3)CCC4=CC5=CC=CC=C5O4)C

InChI

InChI=1S/C29H36N2O2/c1-21-15-24-10-14-31(29(32)18-26(24)16-22(21)2)20-23-7-5-6-12-30(19-23)13-11-27-17-25-8-3-4-9-28(25)33-27/h3-4,8-9,15-17,23H,5-7,10-14,18-20H2,1-2H3