(E)-2-cyano-3-(3,5-dimethoxy-4-oxidanyl-phenyl)-N-(pyridin-4-ylmethyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-(3,5-dimethoxy-4-oxidanyl-phenyl)-N-(pyridin-4-ylmethyl)prop-2-enamide Openeye Name: (E)-2-cyano-3-(4-hydroxy-3,5-dimethoxy-phenyl)-N-(4-pyridylmethyl)prop-2-enamide CAS Name: (E)-2-cyano-3-(4-hydroxy-3,5-dimethoxyphenyl)-N-(pyridin-4-ylmethyl)-2-propenamide IUPAC Name: (E)-2-cyano-3-(4-hydroxy-3,5-dimethoxyphenyl)-N-(pyridin-4-ylmethyl)prop-2-enamide Traditional Name: (E)-2-cyano-3-(4-hydroxy-3,5-dimethoxy-phenyl)-N-(4-pyridylmethyl)acrylamide Formula: C18H17N3O4 MolecularWeight: 339.34528

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)OC)C=C(C#N)C(=O)NCC2=CC=NC=C2

Isomeric SMILES

COC1=CC(=CC(=C1O)OC)/C=C(\C#N)/C(=O)NCC2=CC=NC=C2

InChI

InChI=1S/C18H17N3O4/c1-24-15-8-13(9-16(25-2)17(15)22)7-14(10-19)18(23)21-11-12-3-5-20-6-4-12/h3-9,22H,11H2,1-2H3,(H,21,23)/b14-7+