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

Systemtic Name: ethyl (Z)-2-cyano-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enoate Openeye Name: ethyl (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 ethyl ester IUPAC Name: ethyl (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 ethyl ester Formula: C13H10N2O6 MolecularWeight: 290.2283

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H10N2O6/c1-2-19-13(16)9(6-14)3-8-4-11-12(21-7-20-11)5-10(8)15(17)18/h3-5H,2,7H2,1H3/b9-3-