(E)-N-(1,3-benzodioxol-5-yl)-2-cyano-3-(4-hexoxy-3-methoxy-phenyl)prop-2-enamide

Systemtic Name: (E)-N-(1,3-benzodioxol-5-yl)-2-cyano-3-(4-hexoxy-3-methoxy-phenyl)prop-2-enamide Openeye Name: (E)-N-(1,3-benzodioxol-5-yl)-2-cyano-3-(4-hexoxy-3-methoxy-phenyl)prop-2-enamide CAS Name: (E)-N-(1,3-benzodioxol-5-yl)-2-cyano-3-(4-hexoxy-3-methoxyphenyl)-2-propenamide IUPAC Name: (E)-N-(1,3-benzodioxol-5-yl)-2-cyano-3-(4-hexoxy-3-methoxyphenyl)prop-2-enamide Traditional Name: (E)-N-(1,3-benzodioxol-5-yl)-2-cyano-3-(4-hexoxy-3-methoxy-phenyl)acrylamide Formula: C24H26N2O5 MolecularWeight: 422.47364

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C=C(C#N)C(=O)NC2=CC3=C(C=C2)OCO3)OC

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)/C=C(\C#N)/C(=O)NC2=CC3=C(C=C2)OCO3)OC

InChI

InChI=1S/C24H26N2O5/c1-3-4-5-6-11-29-20-9-7-17(13-22(20)28-2)12-18(15-25)24(27)26-19-8-10-21-23(14-19)31-16-30-21/h7-10,12-14H,3-6,11,16H2,1-2H3,(H,26,27)/b18-12+