3-[2-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]ethyl]-7,8-dimethoxy-1H-3-benzazepin-2-one

Systemtic Name: 3-[2-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]ethyl]-7,8-dimethoxy-1H-3-benzazepin-2-one Openeye Name: 3-[2-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]ethyl]-7,8-dimethoxy-1H-3-benzazepin-2-one CAS Name: 3-[2-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]ethyl]-7,8-dimethoxy-1H-3-benzazepin-2-one IUPAC Name: 3-[2-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]ethyl]-7,8-dimethoxy-1H-3-benzazepin-2-one Traditional Name: 3-[2-[homoveratryl(methyl)amino]ethyl]-7,8-dimethoxy-1H-3-benzazepin-2-one Formula: C25H32N2O5 MolecularWeight: 440.53198

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC(=C(C=C1)OC)OC)CCN2C=CC3=CC(=C(C=C3CC2=O)OC)OC

Isomeric SMILES

CN(CCC1=CC(=C(C=C1)OC)OC)CCN2C=CC3=CC(=C(C=C3CC2=O)OC)OC

InChI

InChI=1S/C25H32N2O5/c1-26(10-8-18-6-7-21(29-2)22(14-18)30-3)12-13-27-11-9-19-15-23(31-4)24(32-5)16-20(19)17-25(27)28/h6-7,9,11,14-16H,8,10,12-13,17H2,1-5H3