[2,6-bis(bromanyl)-4-cyano-phenyl] ethanoate

Systemtic Name: [2,6-bis(bromanyl)-4-cyano-phenyl] ethanoate Openeye Name: (2,6-dibromo-4-cyano-phenyl) acetate CAS Name: acetic acid (2,6-dibromo-4-cyanophenyl) ester IUPAC Name: (2,6-dibromo-4-cyanophenyl) acetate Traditional Name: acetic acid (2,6-dibromo-4-cyano-phenyl) ester Formula: C9H5Br2NO2 MolecularWeight: 318.9495

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1Br)C#N)Br

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1Br)C#N)Br

InChI

InChI=1S/C9H5Br2NO2/c1-5(13)14-9-7(10)2-6(4-12)3-8(9)11/h2-3H,1H3