sodium 3-phosphanylbenzenesulfonate

Systemtic Name: sodium 3-phosphanylbenzenesulfonate Openeye Name: sodium 3-phosphanylbenzenesulfonate CAS Name: sodium 3-phosphinobenzenesulfonate IUPAC Name: sodium 3-phosphanylbenzenesulfonate Traditional Name: sodium 3-phosphinobesylate Formula: C18H18NaO9P3S3-2 MolecularWeight: 590.436173

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/3C6H7O3PS.Na/c3*7-11(8,9)6-3-1-2-5(10)4-6;/h3*1-4H,10H2,(H,7,8,9);/q;;;+1/p-3