(E)-3-(3,5-dimethoxyphenyl)-N-(2-oxidanylideneazepan-4-yl)prop-2-enamide

Systemtic Name: (E)-3-(3,5-dimethoxyphenyl)-N-(2-oxidanylideneazepan-4-yl)prop-2-enamide Openeye Name: (E)-3-(3,5-dimethoxyphenyl)-N-(2-oxoazepan-4-yl)prop-2-enamide CAS Name: (E)-3-(3,5-dimethoxyphenyl)-N-(2-oxo-4-azepanyl)-2-propenamide IUPAC Name: (E)-3-(3,5-dimethoxyphenyl)-N-(2-oxoazepan-4-yl)prop-2-enamide Traditional Name: (E)-3-(3,5-dimethoxyphenyl)-N-(2-ketoazepan-4-yl)acrylamide Formula: C17H22N2O4 MolecularWeight: 318.36758

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C=CC(=O)NC2CCCNC(=O)C2)OC

Isomeric SMILES

COC1=CC(=CC(=C1)/C=C/C(=O)NC2CCCNC(=O)C2)OC

InChI

InChI=1S/C17H22N2O4/c1-22-14-8-12(9-15(11-14)23-2)5-6-16(20)19-13-4-3-7-18-17(21)10-13/h5-6,8-9,11,13H,3-4,7,10H2,1-2H3,(H,18,21)(H,19,20)/b6-5+