[3-dodecylsulfanyl-2-[8-(3-methoxy-3-oxidanylidene-propanoyl)oxyoctoxy]propyl] 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: [3-dodecylsulfanyl-2-[8-(3-methoxy-3-oxidanylidene-propanoyl)oxyoctoxy]propyl] 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: [3-dodecylsulfanyl-2-[8-(3-methoxy-3-oxo-propanoyl)oxyoctoxy]propyl] 2-(trimethylammonio)ethyl phosphate CAS Name: [3-(dodecylthio)-2-[8-(3-methoxy-1,3-dioxopropoxy)octoxy]propyl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: [3-dodecylsulfanyl-2-[8-(3-methoxy-3-oxopropanoyl)oxyoctoxy]propyl] 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: [2-[8-(3-keto-3-methoxy-propanoyl)oxyoctoxy]-3-(laurylthio)propyl] 2-(trimethylammonio)ethyl phosphate Formula: C32H64NO9PS MolecularWeight: 669.890621

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSCC(COP(=O)([O-])OCC[N+](C)(C)C)OCCCCCCCCOC(=O)CC(=O)OC

Isomeric SMILES

CCCCCCCCCCCCSCC(COP(=O)([O-])OCC[N+](C)(C)C)OCCCCCCCCOC(=O)CC(=O)OC

InChI

InChI=1S/C32H64NO9PS/c1-6-7-8-9-10-11-12-15-18-21-26-44-29-30(28-42-43(36,37)41-25-22-33(2,3)4)39-23-19-16-13-14-17-20-24-40-32(35)27-31(34)38-5/h30H,6-29H2,1-5H3