(3-ethanoylsulfanyl-2-methyl-1-phosphono-propyl)phosphonic acid

Systemtic Name: (3-ethanoylsulfanyl-2-methyl-1-phosphono-propyl)phosphonic acid Openeye Name: (3-acetylsulfanyl-2-methyl-1-phosphono-propyl)phosphonic acid CAS Name: [3-(acetylthio)-2-methyl-1-phosphonopropyl]phosphonic acid IUPAC Name: (3-acetylsulfanyl-2-methyl-1-phosphonopropyl)phosphonic acid Traditional Name: [3-(acetylthio)-2-methyl-1-phosphono-propyl]phosphonic acid Formula: C6H14O7P2S MolecularWeight: 292.183682

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC(=O)C)C(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CC(CSC(=O)C)C(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C6H14O7P2S/c1-4(3-16-5(2)7)6(14(8,9)10)15(11,12)13/h4,6H,3H2,1-2H3,(H2,8,9,10)(H2,11,12,13)