2-phosphonatobenzenesulfonic acid; zirconium(2+); phosphite

Systemtic Name: 2-phosphonatobenzenesulfonic acid; zirconium(2+); phosphite Openeye Name: 2-phosphonatobenzenesulfonic acid; zirconium(2+); phosphite CAS Name: 2-phosphonatobenzenesulfonic acid; zirconium(2+); phosphite IUPAC Name: 2-phosphonatobenzenesulfonic acid; zirconium(2+); phosphite Traditional Name: 2-phosphonatobesylic acid; zirconium(2+); phosphite Formula: C6H5O9P2SZr-3 MolecularWeight: 406.335022

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H7O6PS.O3P.Zr/c7-13(8,9)5-3-1-2-4-6(5)14(10,11)12;1-4(2)3;/h1-4H,(H2,7,8,9)(H,10,11,12);;/q;-3;+2/p-2