trimethyl-[1-[(1-octadecanoyloxy-3-oxidanyl-propan-2-yl)oxy-oxidanyl-phosphoryl]propyl]azanium

Systemtic Name: trimethyl-[1-[(1-octadecanoyloxy-3-oxidanyl-propan-2-yl)oxy-oxidanyl-phosphoryl]propyl]azanium Openeye Name: 1-[hydroxy-[1-(hydroxymethyl)-2-octadecanoyloxy-ethoxy]phosphoryl]propyl-trimethyl-ammonium CAS Name: 1-[hydroxy-[1-hydroxy-3-(1-oxooctadecoxy)propan-2-yl]oxyphosphoryl]propyl-trimethylammonium IUPAC Name: 1-[hydroxy-(1-hydroxy-3-octadecanoyloxypropan-2-yl)oxyphosphoryl]propyl-trimethylazanium Traditional Name: 1-[hydroxy-(1-methylol-2-stearoyloxy-ethoxy)phosphoryl]propyl-trimethyl-ammonium Formula: C27H57NO6P+ MolecularWeight: 522.718341

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OCC(CO)OP(=O)(C(CC)[N+](C)(C)C)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OCC(CO)OP(=O)(C(CC)[N+](C)(C)C)O

InChI

InChI=1S/C27H56NO6P/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-27(30)33-24-25(23-29)34-35(31,32)26(7-2)28(3,4)5/h25-26,29H,6-24H2,1-5H3/p+1