2-phosphonatobenzenesulfonic acid; zirconium(2+)

Systemtic Name: 2-phosphonatobenzenesulfonic acid; zirconium(2+) Openeye Name: 2-phosphonatobenzenesulfonic acid; zirconium(2+) CAS Name: 2-phosphonatobenzenesulfonic acid; zirconium(2+) IUPAC Name: 2-phosphonatobenzenesulfonic acid; zirconium(2+) Traditional Name: 2-phosphonatobesylic acid; zirconium(2+) Formula: C6H5O6PSZr MolecularWeight: 327.363061

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H7O6PS.Zr/c7-13(8,9)5-3-1-2-4-6(5)14(10,11)12;/h1-4H,(H2,7,8,9)(H,10,11,12);/q;+2/p-2