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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C=CC(=O)NC2CCCNC(=O)C2

Isomeric SMILES

COC1=CC=CC(=C1OC)/C=C/C(=O)NC2CCCNC(=O)C2

InChI

InChI=1S/C17H22N2O4/c1-22-14-7-3-5-12(17(14)23-2)8-9-15(20)19-13-6-4-10-18-16(21)11-13/h3,5,7-9,13H,4,6,10-11H2,1-2H3,(H,18,21)(H,19,20)/b9-8+