[hexadecylsulfanyl(phosphono)methyl]phosphonic acid

Systemtic Name: [hexadecylsulfanyl(phosphono)methyl]phosphonic acid Openeye Name: [hexadecylsulfanyl(phosphono)methyl]phosphonic acid CAS Name: [(hexadecylthio)-phosphonomethyl]phosphonic acid IUPAC Name: [hexadecylsulfanyl(phosphono)methyl]phosphonic acid Traditional Name: [(cetylthio)-phosphono-methyl]phosphonic acid Formula: C17H38O6P2S MolecularWeight: 432.492542

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCSC(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCSC(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C17H38O6P2S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-26-17(24(18,19)20)25(21,22)23/h17H,2-16H2,1H3,(H2,18,19,20)(H2,21,22,23)