1-acetyloxydocosan-2-yl 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: 1-acetyloxydocosan-2-yl 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: 1-(acetoxymethyl)henicosyl 2-(trimethylammonio)ethyl phosphate CAS Name: 1-acetyloxydocosan-2-yl 2-(trimethylammonio)ethyl phosphate IUPAC Name: 1-acetyloxydocosan-2-yl 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: 1-(acetoxymethyl)heneicosyl 2-(trimethylammonio)ethyl phosphate Formula: C29H60NO6P MolecularWeight: 549.763561

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCC(COC(=O)C)OP(=O)([O-])OCC[N+](C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCC(COC(=O)C)OP(=O)([O-])OCC[N+](C)(C)C

InChI

InChI=1S/C29H60NO6P/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-29(27-34-28(2)31)36-37(32,33)35-26-25-30(3,4)5/h29H,6-27H2,1-5H3