[2-[methyl(tridecyl)sulfonio]-1-phosphono-ethyl]-oxidanyl-phosphinate

Systemtic Name: [2-[methyl(tridecyl)sulfonio]-1-phosphono-ethyl]-oxidanyl-phosphinate Openeye Name: hydroxy-[2-[methyl(tridecyl)sulfonio]-1-phosphono-ethyl]phosphinate CAS Name: hydroxy-[2-[methyl(tridecyl)sulfonio]-1-phosphonoethyl]phosphinate IUPAC Name: hydroxy-[2-[methyl(tridecyl)sulfonio]-1-phosphonoethyl]phosphinate Traditional Name: hydroxy-[2-[methyl(tridecyl)sulfonio]-1-phosphono-ethyl]phosphinate Formula: C16H36O6P2S MolecularWeight: 418.465962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC[S+](C)CC(P(=O)(O)O)P(=O)(O)[O-]

Isomeric SMILES

CCCCCCCCCCCCC[S+](C)CC(P(=O)(O)O)P(=O)(O)[O-]

InChI

InChI=1S/C16H36O6P2S/c1-3-4-5-6-7-8-9-10-11-12-13-14-25(2)15-16(23(17,18)19)24(20,21)22/h16H,3-15H2,1-2H3,(H3-,17,18,19,20,21,22)