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

Systemtic Name: (E)-3-(4,5-dimethoxy-2-nitro-phenyl)-2-methylsulfonyl-prop-2-enenitrile Openeye Name: (E)-3-(4,5-dimethoxy-2-nitro-phenyl)-2-methylsulfonyl-prop-2-enenitrile CAS Name: (E)-3-(4,5-dimethoxy-2-nitrophenyl)-2-methylsulfonyl-2-propenenitrile IUPAC Name: (E)-3-(4,5-dimethoxy-2-nitrophenyl)-2-methylsulfonylprop-2-enenitrile Traditional Name: (E)-3-(4,5-dimethoxy-2-nitro-phenyl)-2-mesyl-acrylonitrile Formula: C12H12N2O6S MolecularWeight: 312.29848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12N2O6S/c1-19-11-5-8(4-9(7-13)21(3,17)18)10(14(15)16)6-12(11)20-2/h4-6H,1-3H3/b9-4+