7,8-dimethoxy-3-[[1-(3-pyridin-3-ylpropyl)pyrrolidin-3-yl]methyl]-1H-3-benzazepin-2-one

Systemtic Name: 7,8-dimethoxy-3-[[1-(3-pyridin-3-ylpropyl)pyrrolidin-3-yl]methyl]-1H-3-benzazepin-2-one Openeye Name: 7,8-dimethoxy-3-[[1-[3-(3-pyridyl)propyl]pyrrolidin-3-yl]methyl]-1H-3-benzazepin-2-one CAS Name: 7,8-dimethoxy-3-[[1-[3-(3-pyridinyl)propyl]-3-pyrrolidinyl]methyl]-1H-3-benzazepin-2-one IUPAC Name: 7,8-dimethoxy-3-[[1-(3-pyridin-3-ylpropyl)pyrrolidin-3-yl]methyl]-1H-3-benzazepin-2-one Traditional Name: 7,8-dimethoxy-3-[[1-[3-(3-pyridyl)propyl]pyrrolidin-3-yl]methyl]-1H-3-benzazepin-2-one Formula: C25H31N3O3 MolecularWeight: 421.53194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C=CN(C(=O)CC2=C1)CC3CCN(C3)CCCC4=CN=CC=C4)OC

Isomeric SMILES

COC1=C(C=C2C=CN(C(=O)CC2=C1)CC3CCN(C3)CCCC4=CN=CC=C4)OC

InChI

InChI=1S/C25H31N3O3/c1-30-23-13-21-8-12-28(25(29)15-22(21)14-24(23)31-2)18-20-7-11-27(17-20)10-4-6-19-5-3-9-26-16-19/h3,5,8-9,12-14,16,20H,4,6-7,10-11,15,17-18H2,1-2H3