(3-pentadecanoyloxy-2-tricosanoyloxy-propyl) 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: (3-pentadecanoyloxy-2-tricosanoyloxy-propyl) 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: (3-pentadecanoyloxy-2-tricosanoyloxy-propyl) 2-(trimethylammonio)ethyl phosphate CAS Name: [3-(1-oxopentadecoxy)-2-(1-oxotricosoxy)propyl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: (3-pentadecanoyloxy-2-tricosanoyloxypropyl) 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: (3-pentadecanoyloxy-2-tricosanoyloxy-propyl) 2-(trimethylammonio)ethyl phosphate Formula: C46H92NO8P MolecularWeight: 818.198341

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCC(=O)OC(COC(=O)CCCCCCCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCC(=O)OC(COC(=O)CCCCCCCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C

InChI

InChI=1S/C46H92NO8P/c1-6-8-10-12-14-16-18-20-21-22-23-24-25-26-27-29-31-33-35-37-39-46(49)55-44(43-54-56(50,51)53-41-40-47(3,4)5)42-52-45(48)38-36-34-32-30-28-19-17-15-13-11-9-7-2/h44H,6-43H2,1-5H3