2-[[1-icosoxy-3-(octadecanoylamino)propan-2-yl]oxy-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[[1-icosoxy-3-(octadecanoylamino)propan-2-yl]oxy-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium Openeye Name: 2-[hydroxy-[1-(icosoxymethyl)-2-(octadecanoylamino)ethoxy]phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[[1-eicosoxy-3-(1-oxooctadecylamino)propan-2-yl]oxy-hydroxyphosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[hydroxy-[1-icosoxy-3-(octadecanoylamino)propan-2-yl]oxyphosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[[1-(arachyloxymethyl)-2-stearamido-ethoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium Formula: C46H96N2O6P+ MolecularWeight: 804.238001

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C46H95N2O6P/c1-6-8-10-12-14-16-18-20-22-23-24-26-28-30-32-34-36-38-41-52-44-45(54-55(50,51)53-42-40-48(3,4)5)43-47-46(49)39-37-35-33-31-29-27-25-21-19-17-15-13-11-9-7-2/h45H,6-44H2,1-5H3,(H-,47,49,50,51)/p+1