7,8-dimethoxy-3-[[1-[2-(5-methoxy-1-benzothiophen-3-yl)ethyl]piperidin-3-yl]methyl]-2,5-dihydro-1H-3-benzazepin-4-one

Systemtic Name: 7,8-dimethoxy-3-[[1-[2-(5-methoxy-1-benzothiophen-3-yl)ethyl]piperidin-3-yl]methyl]-2,5-dihydro-1H-3-benzazepin-4-one Openeye Name: 7,8-dimethoxy-3-[[1-[2-(5-methoxybenzothiophen-3-yl)ethyl]-3-piperidyl]methyl]-2,5-dihydro-1H-3-benzazepin-4-one CAS Name: 7,8-dimethoxy-3-[[1-[2-(5-methoxy-1-benzothiophen-3-yl)ethyl]-3-piperidinyl]methyl]-2,5-dihydro-1H-3-benzazepin-4-one IUPAC Name: 7,8-dimethoxy-3-[[1-[2-(5-methoxy-1-benzothiophen-3-yl)ethyl]piperidin-3-yl]methyl]-2,5-dihydro-1H-3-benzazepin-4-one Traditional Name: 7,8-dimethoxy-3-[[1-[2-(5-methoxybenzothiophen-3-yl)ethyl]-3-piperidyl]methyl]-2,5-dihydro-1H-3-benzazepin-4-one Formula: C29H36N2O4S MolecularWeight: 508.67214

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)SC=C2CCN3CCCC(C3)CN4CCC5=CC(=C(C=C5CC4=O)OC)OC

Isomeric SMILES

COC1=CC2=C(C=C1)SC=C2CCN3CCCC(C3)CN4CCC5=CC(=C(C=C5CC4=O)OC)OC

InChI

InChI=1S/C29H36N2O4S/c1-33-24-6-7-28-25(16-24)22(19-36-28)8-11-30-10-4-5-20(17-30)18-31-12-9-21-13-26(34-2)27(35-3)14-23(21)15-29(31)32/h6-7,13-14,16,19-20H,4-5,8-12,15,17-18H2,1-3H3