(E)-2-cyano-N-(3-ethanoylphenyl)-3-(4-hexoxy-3-methoxy-phenyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-N-(3-ethanoylphenyl)-3-(4-hexoxy-3-methoxy-phenyl)prop-2-enamide Openeye Name: (E)-N-(3-acetylphenyl)-2-cyano-3-(4-hexoxy-3-methoxy-phenyl)prop-2-enamide CAS Name: (E)-N-(3-acetylphenyl)-2-cyano-3-(4-hexoxy-3-methoxyphenyl)-2-propenamide IUPAC Name: (E)-N-(3-acetylphenyl)-2-cyano-3-(4-hexoxy-3-methoxyphenyl)prop-2-enamide Traditional Name: (E)-N-(3-acetylphenyl)-2-cyano-3-(4-hexoxy-3-methoxy-phenyl)acrylamide Formula: C25H28N2O4 MolecularWeight: 420.50082

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C=C(C#N)C(=O)NC2=CC=CC(=C2)C(=O)C)OC

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)/C=C(\C#N)/C(=O)NC2=CC=CC(=C2)C(=O)C)OC

InChI

InChI=1S/C25H28N2O4/c1-4-5-6-7-13-31-23-12-11-19(15-24(23)30-3)14-21(17-26)25(29)27-22-10-8-9-20(16-22)18(2)28/h8-12,14-16H,4-7,13H2,1-3H3,(H,27,29)/b21-14+