[(4-ethylsulfanylphenyl)sulfanyl-phosphono-methyl]phosphonic acid

Systemtic Name: [(4-ethylsulfanylphenyl)sulfanyl-phosphono-methyl]phosphonic acid Openeye Name: [(4-ethylsulfanylphenyl)sulfanyl-phosphono-methyl]phosphonic acid CAS Name: [[[4-(ethylthio)phenyl]thio]-phosphonomethyl]phosphonic acid IUPAC Name: [(4-ethylsulfanylphenyl)sulfanyl-phosphonomethyl]phosphonic acid Traditional Name: [[[4-(ethylthio)phenyl]thio]-phosphono-methyl]phosphonic acid Formula: C9H14O6P2S2 MolecularWeight: 344.281382

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=C(C=C1)SC(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CCSC1=CC=C(C=C1)SC(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C9H14O6P2S2/c1-2-18-7-3-5-8(6-4-7)19-9(16(10,11)12)17(13,14)15/h3-6,9H,2H2,1H3,(H2,10,11,12)(H2,13,14,15)