carboxy-[3-[(2S,3R)-3-dodecylsulfanyldecan-2-yl]oxypropoxy]-oxidanylidene-phosphanium

Systemtic Name: carboxy-[3-[(2S,3R)-3-dodecylsulfanyldecan-2-yl]oxypropoxy]-oxidanylidene-phosphanium Openeye Name: carboxy-[3-[(1S,2R)-2-dodecylsulfanyl-1-methyl-nonoxy]propoxy]-oxo-phosphonium CAS Name: carboxy-[3-[(2S,3R)-3-(dodecylthio)decan-2-yl]oxypropoxy]-oxophosphonium IUPAC Name: carboxy-[3-[(2S,3R)-3-dodecylsulfanyldecan-2-yl]oxypropoxy]-oxophosphanium Traditional Name: carboxy-keto-[3-[(1S,2R)-2-(laurylthio)-1-methyl-nonoxy]propoxy]phosphonium Formula: C26H52O5PS+ MolecularWeight: 507.726841

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSC(CCCCCCC)C(C)OCCCO[P+](=O)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCS[C@H](CCCCCCC)[C@H](C)OCCCO[P+](=O)C(=O)O

InChI

InChI=1S/C26H51O5PS/c1-4-6-8-10-11-12-13-14-16-18-23-33-25(20-17-15-9-7-5-2)24(3)30-21-19-22-31-32(29)26(27)28/h24-25H,4-23H2,1-3H3/p+1/t24-,25+/m0/s1