2,4-bis(bromanyl)-6-(cyanomethyl)-3-methoxy-phenolate

Systemtic Name: 2,4-bis(bromanyl)-6-(cyanomethyl)-3-methoxy-phenolate Openeye Name: 2,4-dibromo-6-(cyanomethyl)-3-methoxy-phenolate CAS Name: 2,4-dibromo-6-(cyanomethyl)-3-methoxyphenolate IUPAC Name: 2,4-dibromo-6-(cyanomethyl)-3-methoxyphenolate Traditional Name: 2,4-dibromo-6-(cyanomethyl)-3-methoxy-phenolate Formula: C9H6Br2NO2- MolecularWeight: 319.95744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1Br)[O-])CC#N)Br

Isomeric SMILES

COC1=C(C=C(C(=C1Br)[O-])CC#N)Br

InChI

InChI=1S/C9H7Br2NO2/c1-14-9-6(10)4-5(2-3-12)8(13)7(9)11/h4,13H,2H2,1H3/p-1