(E)-2-(bromomethyl)-3-(4,5-dimethoxy-2-nitro-phenyl)prop-2-enenitrile

Systemtic Name: (E)-2-(bromomethyl)-3-(4,5-dimethoxy-2-nitro-phenyl)prop-2-enenitrile Openeye Name: (E)-2-(bromomethyl)-3-(4,5-dimethoxy-2-nitro-phenyl)prop-2-enenitrile CAS Name: (E)-2-(bromomethyl)-3-(4,5-dimethoxy-2-nitrophenyl)-2-propenenitrile IUPAC Name: (E)-2-(bromomethyl)-3-(4,5-dimethoxy-2-nitrophenyl)prop-2-enenitrile Traditional Name: (E)-2-(bromomethyl)-3-(4,5-dimethoxy-2-nitro-phenyl)acrylonitrile Formula: C12H11BrN2O4 MolecularWeight: 327.13074

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C=C(CBr)C#N)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)/C=C(/CBr)\C#N)[N+](=O)[O-])OC

InChI

InChI=1S/C12H11BrN2O4/c1-18-11-4-9(3-8(6-13)7-14)10(15(16)17)5-12(11)19-2/h3-5H,6H2,1-2H3/b8-3-