sodium 2-oxidanylbenzenesulfonate dihydrate

Systemtic Name: sodium 2-oxidanylbenzenesulfonate dihydrate Openeye Name: sodium 2-hydroxybenzenesulfonate dihydrate CAS Name: sodium 2-hydroxybenzenesulfonate dihydrate IUPAC Name: sodium 2-hydroxybenzenesulfonate dihydrate Traditional Name: sodium 2-hydroxybesylate dihydrate Formula: C6H9NaO6S MolecularWeight: 232.18683

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)O)S(=O)(=O)[O-].O.O.[Na+]

Isomeric SMILES

C1=CC=C(C(=C1)O)S(=O)(=O)[O-].O.O.[Na+]

InChI

InChI=1S/C6H6O4S.Na.2H2O/c7-5-3-1-2-4-6(5)11(8,9)10;;;/h1-4,7H,(H,8,9,10);;2*1H2/q;+1;;/p-1