(E)-2-cyano-N-(3,4-dimethoxyphenyl)-3-(7-methoxy-1,3-benzodioxol-5-yl)prop-2-enamide

Systemtic Name: (E)-2-cyano-N-(3,4-dimethoxyphenyl)-3-(7-methoxy-1,3-benzodioxol-5-yl)prop-2-enamide Openeye Name: (E)-2-cyano-N-(3,4-dimethoxyphenyl)-3-(7-methoxy-1,3-benzodioxol-5-yl)prop-2-enamide CAS Name: (E)-2-cyano-N-(3,4-dimethoxyphenyl)-3-(7-methoxy-1,3-benzodioxol-5-yl)-2-propenamide IUPAC Name: (E)-2-cyano-N-(3,4-dimethoxyphenyl)-3-(7-methoxy-1,3-benzodioxol-5-yl)prop-2-enamide Traditional Name: (E)-2-cyano-N-(3,4-dimethoxyphenyl)-3-(7-methoxy-1,3-benzodioxol-5-yl)acrylamide Formula: C20H18N2O6 MolecularWeight: 382.36672

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C(=CC2=CC3=C(C(=C2)OC)OCO3)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)/C(=C/C2=CC3=C(C(=C2)OC)OCO3)/C#N)OC

InChI

InChI=1S/C20H18N2O6/c1-24-15-5-4-14(9-16(15)25-2)22-20(23)13(10-21)6-12-7-17(26-3)19-18(8-12)27-11-28-19/h4-9H,11H2,1-3H3,(H,22,23)/b13-6+