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

Systemtic Name: 2-[[2-(2-methoxyethanoyloxy)-3-octadecanoyloxy-propoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium Openeye Name: 2-[hydroxy-[2-(2-methoxyacetyl)oxy-3-octadecanoyloxy-propoxy]phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[hydroxy-[2-(2-methoxy-1-oxoethoxy)-3-(1-oxooctadecoxy)propoxy]phosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[hydroxy-[2-(2-methoxyacetyl)oxy-3-octadecanoyloxypropoxy]phosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[hydroxy-[2-(2-methoxyacetyl)oxy-3-stearoyloxy-propoxy]phosphoryl]oxyethyl-trimethyl-ammonium Formula: C29H59NO9P+ MolecularWeight: 596.753821

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H58NO9P/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-28(31)36-24-27(39-29(32)26-35-5)25-38-40(33,34)37-23-22-30(2,3)4/h27H,6-26H2,1-5H3/p+1