2-[[1-[hexadecanoyl(methyl)amino]-3-hexadecoxy-propan-2-yl]oxy-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[[1-[hexadecanoyl(methyl)amino]-3-hexadecoxy-propan-2-yl]oxy-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium Openeye Name: 2-[[1-[[hexadecanoyl(methyl)amino]methyl]-2-hexadecoxy-ethoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[[1-hexadecoxy-3-[methyl(1-oxohexadecyl)amino]propan-2-yl]oxy-hydroxyphosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[[1-[hexadecanoyl(methyl)amino]-3-hexadecoxypropan-2-yl]oxy-hydroxyphosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[[1-(cetyloxymethyl)-2-[hexadecanoyl(methyl)amino]ethoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium Formula: C41H86N2O6P+ MolecularWeight: 734.105101

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCC(CN(C)C(=O)CCCCCCCCCCCCCCC)OP(=O)(O)OCC[N+](C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCOCC(CN(C)C(=O)CCCCCCCCCCCCCCC)OP(=O)(O)OCC[N+](C)(C)C

InChI

InChI=1S/C41H85N2O6P/c1-7-9-11-13-15-17-19-21-23-25-27-29-31-33-36-47-39-40(49-50(45,46)48-37-35-43(4,5)6)38-42(3)41(44)34-32-30-28-26-24-22-20-18-16-14-12-10-8-2/h40H,7-39H2,1-6H3/p+1