methyl 4,5-bis(chloranyl)-2-cyano-benzoate

Systemtic Name: methyl 4,5-bis(chloranyl)-2-cyano-benzoate Openeye Name: methyl 4,5-dichloro-2-cyano-benzoate CAS Name: 4,5-dichloro-2-cyanobenzoic acid methyl ester IUPAC Name: methyl 4,5-dichloro-2-cyanobenzoate Traditional Name: 4,5-dichloro-2-cyano-benzoic acid methyl ester Formula: C9H5Cl2NO2 MolecularWeight: 230.0475

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1C#N)Cl)Cl

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1C#N)Cl)Cl

InChI

InChI=1S/C9H5Cl2NO2/c1-14-9(13)6-3-8(11)7(10)2-5(6)4-12/h2-3H,1H3