(4-methylsulfanyl-1-phosphono-butyl)phosphonic acid

Systemtic Name: (4-methylsulfanyl-1-phosphono-butyl)phosphonic acid Openeye Name: (4-methylsulfanyl-1-phosphono-butyl)phosphonic acid CAS Name: [4-(methylthio)-1-phosphonobutyl]phosphonic acid IUPAC Name: (4-methylsulfanyl-1-phosphonobutyl)phosphonic acid Traditional Name: [4-(methylthio)-1-phosphono-butyl]phosphonic acid Formula: C5H14O6P2S MolecularWeight: 264.173582

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Descriptors Computed from Structure

Canonical SMILES:

CSCCCC(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CSCCCC(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C5H14O6P2S/c1-14-4-2-3-5(12(6,7)8)13(9,10)11/h5H,2-4H2,1H3,(H2,6,7,8)(H2,9,10,11)