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

Systemtic Name: (E)-N-(1,3-benzodioxol-5-yl)-3-(4-butoxyphenyl)-2-cyano-prop-2-enamide Openeye Name: (E)-N-(1,3-benzodioxol-5-yl)-3-(4-butoxyphenyl)-2-cyano-prop-2-enamide CAS Name: (E)-N-(1,3-benzodioxol-5-yl)-3-(4-butoxyphenyl)-2-cyano-2-propenamide IUPAC Name: (E)-N-(1,3-benzodioxol-5-yl)-3-(4-butoxyphenyl)-2-cyanoprop-2-enamide Traditional Name: (E)-N-(1,3-benzodioxol-5-yl)-3-(4-butoxyphenyl)-2-cyano-acrylamide Formula: C21H20N2O4 MolecularWeight: 364.3945

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C=C(C#N)C(=O)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCCCOC1=CC=C(C=C1)/C=C(\C#N)/C(=O)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C21H20N2O4/c1-2-3-10-25-18-7-4-15(5-8-18)11-16(13-22)21(24)23-17-6-9-19-20(12-17)27-14-26-19/h4-9,11-12H,2-3,10,14H2,1H3,(H,23,24)/b16-11+