(E)-N-[(3,4-dimethoxyphenyl)methyl]-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-enamide

Systemtic Name: (E)-N-[(3,4-dimethoxyphenyl)methyl]-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-enamide Openeye Name: (E)-N-[(3,4-dimethoxyphenyl)methyl]-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-enamide CAS Name: (E)-N-[(3,4-dimethoxyphenyl)methyl]-3-(6-nitro-4H-1,3-benzodioxin-8-yl)-2-propenamide IUPAC Name: (E)-N-[(3,4-dimethoxyphenyl)methyl]-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-enamide Traditional Name: (E)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)-N-veratryl-acrylamide Formula: C20H20N2O7 MolecularWeight: 400.382

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)C=CC2=CC(=CC3=C2OCOC3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)/C=C/C2=CC(=CC3=C2OCOC3)[N+](=O)[O-])OC

InChI

InChI=1S/C20H20N2O7/c1-26-17-5-3-13(7-18(17)27-2)10-21-19(23)6-4-14-8-16(22(24)25)9-15-11-28-12-29-20(14)15/h3-9H,10-12H2,1-2H3,(H,21,23)/b6-4+