[3-hexadecanoyloxy-2-(12-methoxydodecanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: [3-hexadecanoyloxy-2-(12-methoxydodecanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: [3-hexadecanoyloxy-2-(12-methoxydodecanoyloxy)propyl] 2-(trimethylammonio)ethyl phosphate CAS Name: [2-(12-methoxy-1-oxododecoxy)-3-(1-oxohexadecoxy)propyl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: [3-hexadecanoyloxy-2-(12-methoxydodecanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: [3-hexadecanoyloxy-2-(12-methoxydodecanoyloxy)propyl] 2-(trimethylammonio)ethyl phosphate Formula: C37H74NO9P MolecularWeight: 707.958521

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C37H74NO9P/c1-6-7-8-9-10-11-12-13-14-16-19-22-25-28-36(39)44-33-35(34-46-48(41,42)45-32-30-38(2,3)4)47-37(40)29-26-23-20-17-15-18-21-24-27-31-43-5/h35H,6-34H2,1-5H3