2-[1,3-di(octadecanoyloxy)propan-2-yloxy-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[1,3-di(octadecanoyloxy)propan-2-yloxy-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium Openeye Name: 2-[hydroxy-[2-octadecanoyloxy-1-(octadecanoyloxymethyl)ethoxy]phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[1,3-bis(1-oxooctadecoxy)propan-2-yloxy-hydroxyphosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[1,3-di(octadecanoyloxy)propan-2-yloxy-hydroxyphosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[hydroxy-[2-stearoyloxy-1-(stearoyloxymethyl)ethoxy]phosphoryl]oxyethyl-trimethyl-ammonium Formula: C44H89NO8P+ MolecularWeight: 791.153121

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCCCC)OP(=O)(O)OCC[N+](C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCCCC)OP(=O)(O)OCC[N+](C)(C)C

InChI

InChI=1S/C44H88NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(46)50-40-42(53-54(48,49)52-39-38-45(3,4)5)41-51-44(47)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h42H,6-41H2,1-5H3/p+1