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

Systemtic Name: 7,8-dimethoxy-3-[[1-(3-pyridin-3-ylpropyl)piperidin-3-yl]methyl]-1H-3-benzazepin-2-one Openeye Name: 7,8-dimethoxy-3-[[1-[3-(3-pyridyl)propyl]-3-piperidyl]methyl]-1H-3-benzazepin-2-one CAS Name: 7,8-dimethoxy-3-[[1-[3-(3-pyridinyl)propyl]-3-piperidinyl]methyl]-1H-3-benzazepin-2-one IUPAC Name: 7,8-dimethoxy-3-[[1-(3-pyridin-3-ylpropyl)piperidin-3-yl]methyl]-1H-3-benzazepin-2-one Traditional Name: 7,8-dimethoxy-3-[[1-[3-(3-pyridyl)propyl]-3-piperidyl]methyl]-1H-3-benzazepin-2-one Formula: C26H33N3O3 MolecularWeight: 435.55852

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C=CN(C(=O)CC2=C1)CC3CCCN(C3)CCCC4=CN=CC=C4)OC

Isomeric SMILES

COC1=C(C=C2C=CN(C(=O)CC2=C1)CC3CCCN(C3)CCCC4=CN=CC=C4)OC

InChI

InChI=1S/C26H33N3O3/c1-31-24-14-22-9-13-29(26(30)16-23(22)15-25(24)32-2)19-21-8-5-12-28(18-21)11-4-7-20-6-3-10-27-17-20/h3,6,9-10,13-15,17,21H,4-5,7-8,11-12,16,18-19H2,1-2H3