(E)-2-cyano-N-(4-ethanoylphenyl)-3-[4-methoxy-3-(phenoxymethyl)phenyl]prop-2-enamide

Systemtic Name: (E)-2-cyano-N-(4-ethanoylphenyl)-3-[4-methoxy-3-(phenoxymethyl)phenyl]prop-2-enamide Openeye Name: (E)-N-(4-acetylphenyl)-2-cyano-3-[4-methoxy-3-(phenoxymethyl)phenyl]prop-2-enamide CAS Name: (E)-N-(4-acetylphenyl)-2-cyano-3-[4-methoxy-3-(phenoxymethyl)phenyl]-2-propenamide IUPAC Name: (E)-N-(4-acetylphenyl)-2-cyano-3-[4-methoxy-3-(phenoxymethyl)phenyl]prop-2-enamide Traditional Name: (E)-N-(4-acetylphenyl)-2-cyano-3-[4-methoxy-3-(phenoxymethyl)phenyl]acrylamide Formula: C26H22N2O4 MolecularWeight: 426.46388

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)NC(=O)C(=CC2=CC(=C(C=C2)OC)COC3=CC=CC=C3)C#N

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)NC(=O)/C(=C/C2=CC(=C(C=C2)OC)COC3=CC=CC=C3)/C#N

InChI

InChI=1S/C26H22N2O4/c1-18(29)20-9-11-23(12-10-20)28-26(30)21(16-27)14-19-8-13-25(31-2)22(15-19)17-32-24-6-4-3-5-7-24/h3-15H,17H2,1-2H3,(H,28,30)/b21-14+