(E)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4,5-dimethoxy-2-nitro-phenyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4,5-dimethoxy-2-nitro-phenyl)prop-2-enamide Openeye Name: (E)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4,5-dimethoxy-2-nitro-phenyl)prop-2-enamide CAS Name: (E)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4,5-dimethoxy-2-nitrophenyl)-2-propenamide IUPAC Name: (E)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4,5-dimethoxy-2-nitrophenyl)prop-2-enamide Traditional Name: (E)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4,5-dimethoxy-2-nitro-phenyl)acrylamide Formula: C20H17N3O7 MolecularWeight: 411.36488

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C=C(C#N)C(=O)NC2=CC3=C(C=C2)OCCO3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)/C=C(\C#N)/C(=O)NC2=CC3=C(C=C2)OCCO3)[N+](=O)[O-])OC

InChI

InChI=1S/C20H17N3O7/c1-27-17-8-12(15(23(25)26)10-18(17)28-2)7-13(11-21)20(24)22-14-3-4-16-19(9-14)30-6-5-29-16/h3-4,7-10H,5-6H2,1-2H3,(H,22,24)/b13-7+