[3-(14-ethenoxy-14-oxidanylidene-tetradecanoyl)oxy-2-hexadecanoyloxy-propyl] 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: [3-(14-ethenoxy-14-oxidanylidene-tetradecanoyl)oxy-2-hexadecanoyloxy-propyl] 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: [2-hexadecanoyloxy-3-(14-oxo-14-vinyloxy-tetradecanoyl)oxy-propyl] 2-(trimethylammonio)ethyl phosphate CAS Name: [3-(14-ethenoxy-1,14-dioxotetradecoxy)-2-(1-oxohexadecoxy)propyl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: [3-(14-ethenoxy-14-oxotetradecanoyl)oxy-2-hexadecanoyloxypropyl] 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: [2-hexadecanoyloxy-3-(14-keto-14-vinyloxy-tetradecanoyl)oxy-propyl] 2-(trimethylammonio)ethyl phosphate Formula: C40H76NO10P MolecularWeight: 762.005901

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C40H76NO10P/c1-6-8-9-10-11-12-13-14-15-20-23-26-29-32-40(44)51-37(36-50-52(45,46)49-34-33-41(3,4)5)35-48-39(43)31-28-25-22-19-17-16-18-21-24-27-30-38(42)47-7-2/h7,37H,2,6,8-36H2,1,3-5H3