(E)-3-(3-methoxy-4-propoxy-phenyl)-N-[3-(2-oxidanylideneazepan-1-yl)propyl]prop-2-enamide

Systemtic Name: (E)-3-(3-methoxy-4-propoxy-phenyl)-N-[3-(2-oxidanylideneazepan-1-yl)propyl]prop-2-enamide Openeye Name: (E)-3-(3-methoxy-4-propoxy-phenyl)-N-[3-(2-oxoazepan-1-yl)propyl]prop-2-enamide CAS Name: (E)-3-(3-methoxy-4-propoxyphenyl)-N-[3-(2-oxo-1-azepanyl)propyl]-2-propenamide IUPAC Name: (E)-3-(3-methoxy-4-propoxyphenyl)-N-[3-(2-oxoazepan-1-yl)propyl]prop-2-enamide Traditional Name: (E)-N-[3-(2-ketoazepan-1-yl)propyl]-3-(3-methoxy-4-propoxy-phenyl)acrylamide Formula: C22H32N2O4 MolecularWeight: 388.50048

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C=CC(=O)NCCCN2CCCCCC2=O)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)/C=C/C(=O)NCCCN2CCCCCC2=O)OC

InChI

InChI=1S/C22H32N2O4/c1-3-16-28-19-11-9-18(17-20(19)27-2)10-12-21(25)23-13-7-15-24-14-6-4-5-8-22(24)26/h9-12,17H,3-8,13-16H2,1-2H3,(H,23,25)/b12-10+