[2-[methyl(3-phenylpropyl)sulfonio]-1-oxidanyl-1-phosphono-ethyl]-oxidanyl-phosphinate

Systemtic Name: [2-[methyl(3-phenylpropyl)sulfonio]-1-oxidanyl-1-phosphono-ethyl]-oxidanyl-phosphinate Openeye Name: hydroxy-[1-hydroxy-2-[methyl(3-phenylpropyl)sulfonio]-1-phosphono-ethyl]phosphinate CAS Name: hydroxy-[1-hydroxy-2-[methyl(3-phenylpropyl)sulfonio]-1-phosphonoethyl]phosphinate IUPAC Name: hydroxy-[1-hydroxy-2-[methyl(3-phenylpropyl)sulfonio]-1-phosphonoethyl]phosphinate Traditional Name: hydroxy-[1-hydroxy-2-[methyl(3-phenylpropyl)sulfonio]-1-phosphono-ethyl]phosphinate Formula: C12H20O7P2S MolecularWeight: 370.295522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[S+](CCCC1=CC=CC=C1)CC(O)(P(=O)(O)O)P(=O)(O)[O-]

Isomeric SMILES

C[S+](CCCC1=CC=CC=C1)CC(O)(P(=O)(O)O)P(=O)(O)[O-]

InChI

InChI=1S/C12H20O7P2S/c1-22(9-5-8-11-6-3-2-4-7-11)10-12(13,20(14,15)16)21(17,18)19/h2-4,6-7,13H,5,8-10H2,1H3,(H3-,14,15,16,17,18,19)