[1-[hexadecanoyl(methyl)amino]-3-octadecoxy-propan-2-yl] 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: [1-[hexadecanoyl(methyl)amino]-3-octadecoxy-propan-2-yl] 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: [1-[[hexadecanoyl(methyl)amino]methyl]-2-octadecoxy-ethyl] 2-(trimethylammonio)ethyl phosphate CAS Name: [1-[methyl(1-oxohexadecyl)amino]-3-octadecoxypropan-2-yl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: [1-[hexadecanoyl(methyl)amino]-3-octadecoxypropan-2-yl] 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: [1-[[hexadecanoyl(methyl)amino]methyl]-2-stearyloxy-ethyl] 2-(trimethylammonio)ethyl phosphate Formula: C43H89N2O6P MolecularWeight: 761.150321

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C43H89N2O6P/c1-7-9-11-13-15-17-19-21-22-23-25-27-29-31-33-35-38-49-41-42(51-52(47,48)50-39-37-45(4,5)6)40-44(3)43(46)36-34-32-30-28-26-24-20-18-16-14-12-10-8-2/h42H,7-41H2,1-6H3