trisodium (phenylmethylsulfanyl)-phosphonatooxy-phosphinate

Systemtic Name: trisodium (phenylmethylsulfanyl)-phosphonatooxy-phosphinate Openeye Name: trisodium benzylsulfanyl(phosphonatooxy)phosphinate CAS Name: trisodium (phenylmethylthio)-phosphonatooxyphosphinate IUPAC Name: trisodium benzylsulfanyl(phosphonatooxy)phosphinate Traditional Name: trisodium (benzylthio)-phosphato-phosphinate Formula: C7H7Na3O6P2S MolecularWeight: 350.108712

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSP(=O)([O-])OP(=O)([O-])[O-].[Na+].[Na+].[Na+]

Isomeric SMILES

C1=CC=C(C=C1)CSP(=O)([O-])OP(=O)([O-])[O-].[Na+].[Na+].[Na+]

InChI

InChI=1S/C7H10O6P2S.3Na/c8-14(9,10)13-15(11,12)16-6-7-4-2-1-3-5-7;;;/h1-5H,6H2,(H,11,12)(H2,8,9,10);;;/q;3*+1/p-3