sodium 2-methyl-3-oxidanyl-benzenesulfonate

Systemtic Name: sodium 2-methyl-3-oxidanyl-benzenesulfonate Openeye Name: sodium 3-hydroxy-2-methyl-benzenesulfonate CAS Name: sodium 3-hydroxy-2-methylbenzenesulfonate IUPAC Name: sodium 3-hydroxy-2-methylbenzenesulfonate Traditional Name: sodium 3-hydroxy-2-methyl-besylate Formula: C7H7NaO4S MolecularWeight: 210.18285

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1S(=O)(=O)[O-])O.[Na+]

Isomeric SMILES

CC1=C(C=CC=C1S(=O)(=O)[O-])O.[Na+]

InChI

InChI=1S/C7H8O4S.Na/c1-5-6(8)3-2-4-7(5)12(9,10)11;/h2-4,8H,1H3,(H,9,10,11);/q;+1/p-1