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

Systemtic Name: trimethyl-[2-[[(2S)-3-octadecanoyloxy-2-oxidanyl-propoxy]-oxidanyl-phosphoryl]oxyethyl]azanium chloride Openeye Name: 2-[hydroxy-[(2S)-2-hydroxy-3-octadecanoyloxy-propoxy]phosphoryl]oxyethyl-trimethyl-ammonium chloride CAS Name: 2-[hydroxy-[(2S)-2-hydroxy-3-(1-oxooctadecoxy)propoxy]phosphoryl]oxyethyl-trimethylammonium chloride IUPAC Name: 2-[hydroxy-[(2S)-2-hydroxy-3-octadecanoyloxypropoxy]phosphoryl]oxyethyl-trimethylazanium chloride Traditional Name: 2-[hydroxy-[(2S)-2-hydroxy-3-stearoyloxy-propoxy]phosphoryl]oxyethyl-trimethyl-ammonium chloride Formula: C26H55ClNO7P MolecularWeight: 560.144161

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OCC[N+](C)(C)C)O.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OC[C@@H](COP(=O)(O)OCC[N+](C)(C)C)O.[Cl-]

InChI

InChI=1S/C26H54NO7P.ClH/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-26(29)32-23-25(28)24-34-35(30,31)33-22-21-27(2,3)4;/h25,28H,5-24H2,1-4H3;1H/t25-;/m0./s1