2-[[2-(2-bromanyloctadecanoyloxy)-3-hexadecoxy-propoxy]-oxidanyl-phosphanyl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[[2-(2-bromanyloctadecanoyloxy)-3-hexadecoxy-propoxy]-oxidanyl-phosphanyl]oxyethyl-trimethyl-azanium Openeye Name: 2-[[2-(2-bromooctadecanoyloxy)-3-hexadecoxy-propoxy]-hydroxy-phosphanyl]oxyethyl-trimethyl-ammonium CAS Name: 2-[[2-(2-bromo-1-oxooctadecoxy)-3-hexadecoxypropoxy]-hydroxyphosphino]oxyethyl-trimethylammonium IUPAC Name: 2-[[2-(2-bromooctadecanoyloxy)-3-hexadecoxypropoxy]-hydroxyphosphanyl]oxyethyl-trimethylazanium Traditional Name: 2-[[2-(2-bromooctadecanoyloxy)-3-cetyloxy-propoxy]-hydroxy-phosphino]oxyethyl-trimethyl-ammonium Formula: C42H86BrNO6P+ MolecularWeight: 812.013101

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(C(=O)OC(COCCCCCCCCCCCCCCCC)COP(O)OCC[N+](C)(C)C)Br

Isomeric SMILES

CCCCCCCCCCCCCCCCC(C(=O)OC(COCCCCCCCCCCCCCCCC)COP(O)OCC[N+](C)(C)C)Br

InChI

InChI=1S/C42H86BrNO6P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-41(43)42(45)50-40(39-49-51(46)48-37-35-44(3,4)5)38-47-36-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h40-41,46H,6-39H2,1-5H3/q+1