(E)-2-cyano-3-(3-ethoxy-4-prop-2-ynoxy-phenyl)-N-(6-nitro-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-(3-ethoxy-4-prop-2-ynoxy-phenyl)-N-(6-nitro-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enamide Openeye Name: (E)-2-cyano-3-(3-ethoxy-4-prop-2-ynoxy-phenyl)-N-(6-nitro-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enamide CAS Name: (E)-2-cyano-3-(3-ethoxy-4-prop-2-ynoxyphenyl)-N-(6-nitro-2,3-dihydro-1,4-benzodioxin-7-yl)-2-propenamide IUPAC Name: (E)-2-cyano-3-(3-ethoxy-4-prop-2-ynoxyphenyl)-N-(6-nitro-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enamide Traditional Name: (E)-2-cyano-3-(3-ethoxy-4-propargyloxy-phenyl)-N-(6-nitro-2,3-dihydro-1,4-benzodioxin-7-yl)acrylamide Formula: C23H19N3O7 MolecularWeight: 449.41286

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C(C#N)C(=O)NC2=CC3=C(C=C2[N+](=O)[O-])OCCO3)OCC#C

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C(\C#N)/C(=O)NC2=CC3=C(C=C2[N+](=O)[O-])OCCO3)OCC#C

InChI

InChI=1S/C23H19N3O7/c1-3-7-31-19-6-5-15(11-20(19)30-4-2)10-16(14-24)23(27)25-17-12-21-22(33-9-8-32-21)13-18(17)26(28)29/h1,5-6,10-13H,4,7-9H2,2H3,(H,25,27)/b16-10+