calcium 2-oxidanylbenzenesulfonate

Systemtic Name: calcium 2-oxidanylbenzenesulfonate Openeye Name: calcium 2-hydroxybenzenesulfonate CAS Name: calcium 2-hydroxybenzenesulfonate IUPAC Name: calcium 2-hydroxybenzenesulfonate Traditional Name: calcium 2-hydroxybesylate Formula: C12H10CaO8S2 MolecularWeight: 386.411

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)O)S(=O)(=O)[O-].C1=CC=C(C(=C1)O)S(=O)(=O)[O-].[Ca+2]

Isomeric SMILES

C1=CC=C(C(=C1)O)S(=O)(=O)[O-].C1=CC=C(C(=C1)O)S(=O)(=O)[O-].[Ca+2]

InChI

InChI=1S/2C6H6O4S.Ca/c2*7-5-3-1-2-4-6(5)11(8,9)10;/h2*1-4,7H,(H,8,9,10);/q;;+2/p-2