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

Systemtic Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-7,8-dimethoxy-1H-3-benzazepin-2-one Openeye Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-7,8-dimethoxy-1H-3-benzazepin-2-one CAS Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-7,8-dimethoxy-1H-3-benzazepin-2-one IUPAC Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-7,8-dimethoxy-1H-3-benzazepin-2-one Traditional Name: 3-homoveratryl-7,8-dimethoxy-1H-3-benzazepin-2-one Formula: C22H25NO5 MolecularWeight: 383.4376

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN2C=CC3=CC(=C(C=C3CC2=O)OC)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN2C=CC3=CC(=C(C=C3CC2=O)OC)OC)OC

InChI

InChI=1S/C22H25NO5/c1-25-18-6-5-15(11-19(18)26-2)7-9-23-10-8-16-12-20(27-3)21(28-4)13-17(16)14-22(23)24/h5-6,8,10-13H,7,9,14H2,1-4H3