sodium 3,5-bis(chloranyl)-4-methyl-2-oxidanyl-benzenesulfonate

Systemtic Name: sodium 3,5-bis(chloranyl)-4-methyl-2-oxidanyl-benzenesulfonate Openeye Name: sodium 3,5-dichloro-2-hydroxy-4-methyl-benzenesulfonate CAS Name: sodium 3,5-dichloro-2-hydroxy-4-methylbenzenesulfonate IUPAC Name: sodium 3,5-dichloro-2-hydroxy-4-methylbenzenesulfonate Traditional Name: sodium 3,5-dichloro-2-hydroxy-4-methyl-besylate Formula: C7H5Cl2NaO4S MolecularWeight: 279.07297

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1Cl)O)S(=O)(=O)[O-])Cl.[Na+]

Isomeric SMILES

CC1=C(C=C(C(=C1Cl)O)S(=O)(=O)[O-])Cl.[Na+]

InChI

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