[3-dodecylsulfanyldecan-2-yloxy(propoxy)phosphoryl] hydrogen carbonate

Systemtic Name: [3-dodecylsulfanyldecan-2-yloxy(propoxy)phosphoryl] hydrogen carbonate Openeye Name: [(2-dodecylsulfanyl-1-methyl-nonoxy)-propoxy-phosphoryl] hydrogen carbonate CAS Name: carbonic acid [3-(dodecylthio)decan-2-yloxy-propoxyphosphoryl] ester IUPAC Name: [3-dodecylsulfanyldecan-2-yloxy(propoxy)phosphoryl] hydrogen carbonate Traditional Name: carbonic acid [[2-(laurylthio)-1-methyl-nonoxy]-propoxy-phosphoryl] ester Formula: C26H53O6PS MolecularWeight: 524.734181

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSC(CCCCCCC)C(C)OP(=O)(OCCC)OC(=O)O

Isomeric SMILES

CCCCCCCCCCCCSC(CCCCCCC)C(C)OP(=O)(OCCC)OC(=O)O

InChI

InChI=1S/C26H53O6PS/c1-5-8-10-12-13-14-15-16-18-20-23-34-25(21-19-17-11-9-6-2)24(4)31-33(29,30-22-7-3)32-26(27)28/h24-25H,5-23H2,1-4H3,(H,27,28)