3-[3-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]propyl]-7-oxidanyl-8-phenylmethoxy-2,5-dihydro-1H-3-benzazepin-4-one

Systemtic Name: 3-[3-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]propyl]-7-oxidanyl-8-phenylmethoxy-2,5-dihydro-1H-3-benzazepin-4-one Openeye Name: 8-benzyloxy-3-[3-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]propyl]-7-hydroxy-2,5-dihydro-1H-3-benzazepin-4-one CAS Name: 3-[3-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]propyl]-7-hydroxy-8-phenylmethoxy-2,5-dihydro-1H-3-benzazepin-4-one IUPAC Name: 3-[3-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]propyl]-7-hydroxy-8-phenylmethoxy-2,5-dihydro-1H-3-benzazepin-4-one Traditional Name: 8-benzoxy-3-[3-[homoveratryl(methyl)amino]propyl]-7-hydroxy-2,5-dihydro-1H-3-benzazepin-4-one Formula: C31H38N2O5 MolecularWeight: 518.64382

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCN1CCC2=CC(=C(C=C2CC1=O)O)OCC3=CC=CC=C3)CCC4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CN(CCCN1CCC2=CC(=C(C=C2CC1=O)O)OCC3=CC=CC=C3)CCC4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C31H38N2O5/c1-32(16-12-23-10-11-28(36-2)30(18-23)37-3)14-7-15-33-17-13-25-20-29(27(34)19-26(25)21-31(33)35)38-22-24-8-5-4-6-9-24/h4-6,8-11,18-20,34H,7,12-17,21-22H2,1-3H3