[1-(hexadecanoylamino)-3-icosoxy-propan-2-yl] 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: [1-(hexadecanoylamino)-3-icosoxy-propan-2-yl] 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: [1-[(hexadecanoylamino)methyl]-2-icosoxy-ethyl] 2-(trimethylammonio)ethyl phosphate CAS Name: [1-eicosoxy-3-(1-oxohexadecylamino)propan-2-yl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: [1-(hexadecanoylamino)-3-icosoxypropan-2-yl] 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: [1-(arachyloxymethyl)-2-palmitamido-ethyl] 2-(trimethylammonio)ethyl phosphate Formula: C44H91N2O6P MolecularWeight: 775.176901

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCOCC(CNC(=O)CCCCCCCCCCCCCCC)OP(=O)([O-])OCC[N+](C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCOCC(CNC(=O)CCCCCCCCCCCCCCC)OP(=O)([O-])OCC[N+](C)(C)C

InChI

InChI=1S/C44H91N2O6P/c1-6-8-10-12-14-16-18-20-21-22-23-24-26-28-30-32-34-36-39-50-42-43(52-53(48,49)51-40-38-46(3,4)5)41-45-44(47)37-35-33-31-29-27-25-19-17-15-13-11-9-7-2/h43H,6-42H2,1-5H3,(H-,45,47,48,49)