(2-methoxy-3-octadecylsulfanyl-propyl) 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: (2-methoxy-3-octadecylsulfanyl-propyl) 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: (2-methoxy-3-octadecylsulfanyl-propyl) 2-(trimethylammonio)ethyl phosphate CAS Name: [2-methoxy-3-(octadecylthio)propyl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: (2-methoxy-3-octadecylsulfanylpropyl) 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: [2-methoxy-3-(stearylthio)propyl] 2-(trimethylammonio)ethyl phosphate Formula: C27H58NO5PS MolecularWeight: 539.791881

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCSCC(COP(=O)([O-])OCC[N+](C)(C)C)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCSCC(COP(=O)([O-])OCC[N+](C)(C)C)OC

InChI

InChI=1S/C27H58NO5PS/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24-35-26-27(31-5)25-33-34(29,30)32-23-22-28(2,3)4/h27H,6-26H2,1-5H3