[1-[2-(hexadecanoylamino)-2-methyl-propoxy]-2-(trimethylazaniumyl)ethyl] hydrogen phosphate

Systemtic Name: [1-[2-(hexadecanoylamino)-2-methyl-propoxy]-2-(trimethylazaniumyl)ethyl] hydrogen phosphate Openeye Name: [1-[2-(hexadecanoylamino)-2-methyl-propoxy]-2-(trimethylammonio)ethyl] hydrogen phosphate CAS Name: [1-[2-methyl-2-(1-oxohexadecylamino)propoxy]-2-(trimethylammonio)ethyl] hydrogen phosphate IUPAC Name: [1-[2-(hexadecanoylamino)-2-methylpropoxy]-2-(trimethylazaniumyl)ethyl] hydrogen phosphate Traditional Name: [1-(2-methyl-2-palmitamido-propoxy)-2-(trimethylammonio)ethyl] hydrogen phosphate Formula: C25H53N2O6P MolecularWeight: 508.671881

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)NC(C)(C)COC(C[N+](C)(C)C)OP(=O)(O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)NC(C)(C)COC(C[N+](C)(C)C)OP(=O)(O)[O-]

InChI

InChI=1S/C25H53N2O6P/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23(28)26-25(2,3)22-32-24(21-27(4,5)6)33-34(29,30)31/h24H,7-22H2,1-6H3,(H2-,26,28,29,30,31)