4-[2-(3,4-dimethoxyphenyl)ethyl]-7-methoxy-5H-1,4-benzoxazepin-3-one

Systemtic Name: 4-[2-(3,4-dimethoxyphenyl)ethyl]-7-methoxy-5H-1,4-benzoxazepin-3-one Openeye Name: 4-[2-(3,4-dimethoxyphenyl)ethyl]-7-methoxy-5H-1,4-benzoxazepin-3-one CAS Name: 4-[2-(3,4-dimethoxyphenyl)ethyl]-7-methoxy-5H-1,4-benzoxazepin-3-one IUPAC Name: 4-[2-(3,4-dimethoxyphenyl)ethyl]-7-methoxy-5H-1,4-benzoxazepin-3-one Traditional Name: 4-homoveratryl-7-methoxy-5H-1,4-benzoxazepin-3-one Formula: C20H23NO5 MolecularWeight: 357.40032

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)OCC(=O)N(C2)CCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

COC1=CC2=C(C=C1)OCC(=O)N(C2)CCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C20H23NO5/c1-23-16-5-7-17-15(11-16)12-21(20(22)13-26-17)9-8-14-4-6-18(24-2)19(10-14)25-3/h4-7,10-11H,8-9,12-13H2,1-3H3