methyl (Z)-2-cyano-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enoate

Systemtic Name: methyl (Z)-2-cyano-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enoate Openeye Name: methyl (Z)-2-cyano-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enoate CAS Name: (Z)-2-cyano-3-(6-nitro-1,3-benzodioxol-5-yl)-2-propenoic acid methyl ester IUPAC Name: methyl (Z)-2-cyano-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enoate Traditional Name: (Z)-2-cyano-3-(6-nitro-1,3-benzodioxol-5-yl)acrylic acid methyl ester Formula: C12H8N2O6 MolecularWeight: 276.20172

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=CC1=CC2=C(C=C1[N+](=O)[O-])OCO2)C#N

Isomeric SMILES

COC(=O)/C(=C\C1=CC2=C(C=C1[N+](=O)[O-])OCO2)/C#N

InChI

InChI=1S/C12H8N2O6/c1-18-12(15)8(5-13)2-7-3-10-11(20-6-19-10)4-9(7)14(16)17/h2-4H,6H2,1H3/b8-2-