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

Systemtic Name: (2-heptadecanoyloxy-3-pentadecanoyloxy-propyl) 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: (2-heptadecanoyloxy-3-pentadecanoyloxy-propyl) 2-(trimethylammonio)ethyl phosphate CAS Name: [2-(1-oxoheptadecoxy)-3-(1-oxopentadecoxy)propyl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: (2-heptadecanoyloxy-3-pentadecanoyloxypropyl) 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: (2-heptadecanoyloxy-3-pentadecanoyloxy-propyl) 2-(trimethylammonio)ethyl phosphate Formula: C40H80NO8P MolecularWeight: 734.038861

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C40H80NO8P/c1-6-8-10-12-14-16-18-20-21-23-25-27-29-31-33-40(43)49-38(37-48-50(44,45)47-35-34-41(3,4)5)36-46-39(42)32-30-28-26-24-22-19-17-15-13-11-9-7-2/h38H,6-37H2,1-5H3