calcium 4-oxidanylbenzenesulfonate

Systemtic Name: calcium 4-oxidanylbenzenesulfonate Openeye Name: calcium 4-hydroxybenzenesulfonate CAS Name: calcium 4-hydroxybenzenesulfonate IUPAC Name: calcium 4-hydroxybenzenesulfonate Traditional Name: calcium 4-hydroxybesylate Formula: C12H10CaO8S2 MolecularWeight: 386.411

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1O)S(=O)(=O)[O-].C1=CC(=CC=C1O)S(=O)(=O)[O-].[Ca+2]

Isomeric SMILES

C1=CC(=CC=C1O)S(=O)(=O)[O-].C1=CC(=CC=C1O)S(=O)(=O)[O-].[Ca+2]

InChI

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