trimethyl-[2-[(3-octadecanoyloxy-2-pentadecanoyloxy-propoxy)-oxidanyl-phosphoryl]oxyethyl]azanium

Systemtic Name: trimethyl-[2-[(3-octadecanoyloxy-2-pentadecanoyloxy-propoxy)-oxidanyl-phosphoryl]oxyethyl]azanium Openeye Name: 2-[hydroxy-(3-octadecanoyloxy-2-pentadecanoyloxy-propoxy)phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[hydroxy-[3-(1-oxooctadecoxy)-2-(1-oxopentadecoxy)propoxy]phosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[hydroxy-(3-octadecanoyloxy-2-pentadecanoyloxypropoxy)phosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[hydroxy-(2-pentadecanoyloxy-3-stearoyloxy-propoxy)phosphoryl]oxyethyl-trimethyl-ammonium Formula: C41H83NO8P+ MolecularWeight: 749.073381

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCC

InChI

InChI=1S/C41H82NO8P/c1-6-8-10-12-14-16-18-20-21-22-24-25-27-29-31-33-40(43)47-37-39(38-49-51(45,46)48-36-35-42(3,4)5)50-41(44)34-32-30-28-26-23-19-17-15-13-11-9-7-2/h39H,6-38H2,1-5H3/p+1