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

Systemtic Name: 3-[[1-[2-(4-aminophenyl)ethyl]piperidin-3-yl]methyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one Openeye Name: 3-[[1-[2-(4-aminophenyl)ethyl]-3-piperidyl]methyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one CAS Name: 3-[[1-[2-(4-aminophenyl)ethyl]-3-piperidinyl]methyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one IUPAC Name: 3-[[1-[2-(4-aminophenyl)ethyl]piperidin-3-yl]methyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one Traditional Name: 3-[[1-[2-(4-aminophenyl)ethyl]-3-piperidyl]methyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one Formula: C26H35N3O3 MolecularWeight: 437.5744

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CC(=O)N(CCC2=C1)CC3CCCN(C3)CCC4=CC=C(C=C4)N)OC

Isomeric SMILES

COC1=C(C=C2CC(=O)N(CCC2=C1)CC3CCCN(C3)CCC4=CC=C(C=C4)N)OC

InChI

InChI=1S/C26H35N3O3/c1-31-24-14-21-10-13-29(26(30)16-22(21)15-25(24)32-2)18-20-4-3-11-28(17-20)12-9-19-5-7-23(27)8-6-19/h5-8,14-15,20H,3-4,9-13,16-18,27H2,1-2H3