sodium 3,5-bis(chloranyl)-4-methoxy-benzenesulfonate

Systemtic Name: sodium 3,5-bis(chloranyl)-4-methoxy-benzenesulfonate Openeye Name: sodium 3,5-dichloro-4-methoxy-benzenesulfonate CAS Name: sodium 3,5-dichloro-4-methoxybenzenesulfonate IUPAC Name: sodium 3,5-dichloro-4-methoxybenzenesulfonate Traditional Name: sodium 3,5-dichloro-4-methoxy-besylate Formula: C7H5Cl2NaO4S MolecularWeight: 279.07297

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1Cl)S(=O)(=O)[O-])Cl.[Na+]

Isomeric SMILES

COC1=C(C=C(C=C1Cl)S(=O)(=O)[O-])Cl.[Na+]

InChI

InChI=1S/C7H6Cl2O4S.Na/c1-13-7-5(8)2-4(3-6(7)9)14(10,11)12;/h2-3H,1H3,(H,10,11,12);/q;+1/p-1