[(4-methylsulfanylphenyl)sulfanyl-phosphono-methyl]phosphonic acid; sodium

Systemtic Name: [(4-methylsulfanylphenyl)sulfanyl-phosphono-methyl]phosphonic acid; sodium Openeye Name: [(4-methylsulfanylphenyl)sulfanyl-phosphono-methyl]phosphonic acid; sodium CAS Name: [[[4-(methylthio)phenyl]thio]-phosphonomethyl]phosphonic acid; sodium IUPAC Name: [(4-methylsulfanylphenyl)sulfanyl-phosphonomethyl]phosphonic acid; sodium Traditional Name: [[[4-(methylthio)phenyl]thio]-phosphono-methyl]phosphonic acid; sodium Formula: C8H12Na2O6P2S2 MolecularWeight: 376.234342

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)SC(P(=O)(O)O)P(=O)(O)O.[Na].[Na]

Isomeric SMILES

CSC1=CC=C(C=C1)SC(P(=O)(O)O)P(=O)(O)O.[Na].[Na]

InChI

InChI=1S/C8H12O6P2S2.2Na/c1-17-6-2-4-7(5-3-6)18-8(15(9,10)11)16(12,13)14;;/h2-5,8H,1H3,(H2,9,10,11)(H2,12,13,14);;