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

Systemtic Name: 3-[[1-[4-(1-benzothiophen-3-yl)butyl]piperidin-3-yl]methyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one Openeye Name: 3-[[1-[4-(benzothiophen-3-yl)butyl]-3-piperidyl]methyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one CAS Name: 3-[[1-[4-(1-benzothiophen-3-yl)butyl]-3-piperidinyl]methyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one IUPAC Name: 3-[[1-[4-(1-benzothiophen-3-yl)butyl]piperidin-3-yl]methyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one Traditional Name: 3-[[1-[4-(benzothiophen-3-yl)butyl]-3-piperidyl]methyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one Formula: C30H38N2O3S MolecularWeight: 506.69932

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CC(=O)N(CCC2=C1)CC3CCCN(C3)CCCCC4=CSC5=CC=CC=C54)OC

Isomeric SMILES

COC1=C(C=C2CC(=O)N(CCC2=C1)CC3CCCN(C3)CCCCC4=CSC5=CC=CC=C54)OC

InChI

InChI=1S/C30H38N2O3S/c1-34-27-16-23-12-15-32(30(33)18-25(23)17-28(27)35-2)20-22-8-7-14-31(19-22)13-6-5-9-24-21-36-29-11-4-3-10-26(24)29/h3-4,10-11,16-17,21-22H,5-9,12-15,18-20H2,1-2H3