[2-(hexadecanoylamino)-4-methyl-pentyl] 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: [2-(hexadecanoylamino)-4-methyl-pentyl] 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: [2-(hexadecanoylamino)-4-methyl-pentyl] 2-(trimethylammonio)ethyl phosphate CAS Name: [4-methyl-2-(1-oxohexadecylamino)pentyl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: [2-(hexadecanoylamino)-4-methylpentyl] 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: (4-methyl-2-palmitamido-pentyl) 2-(trimethylammonio)ethyl phosphate Formula: C27H57N2O5P MolecularWeight: 520.725641

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)NC(CC(C)C)COP(=O)([O-])OCC[N+](C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)NC(CC(C)C)COP(=O)([O-])OCC[N+](C)(C)C

InChI

InChI=1S/C27H57N2O5P/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-27(30)28-26(23-25(2)3)24-34-35(31,32)33-22-21-29(4,5)6/h25-26H,7-24H2,1-6H3,(H-,28,30,31,32)