[1-[(E)-octadec-9-enoxy]-3-oxidanyl-propan-2-yl] 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: [1-[(E)-octadec-9-enoxy]-3-oxidanyl-propan-2-yl] 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: [1-(hydroxymethyl)-2-[(E)-octadec-9-enoxy]ethyl] 2-(trimethylammonio)ethyl phosphate CAS Name: [1-hydroxy-3-[(E)-octadec-9-enoxy]propan-2-yl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: [1-hydroxy-3-[(E)-octadec-9-enoxy]propan-2-yl] 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: [1-methylol-2-[(E)-octadec-9-enoxy]ethyl] 2-(trimethylammonio)ethyl phosphate Formula: C26H54NO6P MolecularWeight: 507.683821

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCOCC(CO)OP(=O)([O-])OCC[N+](C)(C)C

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCOCC(CO)OP(=O)([O-])OCC[N+](C)(C)C

InChI

InChI=1S/C26H54NO6P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22-31-25-26(24-28)33-34(29,30)32-23-21-27(2,3)4/h12-13,26,28H,5-11,14-25H2,1-4H3/b13-12+