[4-(octadecylamino)-2-oxidanyl-4-oxidanylidene-butyl] 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: [4-(octadecylamino)-2-oxidanyl-4-oxidanylidene-butyl] 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: [2-hydroxy-4-(octadecylamino)-4-oxo-butyl] 2-(trimethylammonio)ethyl phosphate CAS Name: [2-hydroxy-4-(octadecylamino)-4-oxobutyl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: [2-hydroxy-4-(octadecylamino)-4-oxobutyl] 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: [2-hydroxy-4-keto-4-(stearylamino)butyl] 2-(trimethylammonio)ethyl phosphate Formula: C27H57N2O6P MolecularWeight: 536.725041

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H57N2O6P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-28-27(31)24-26(30)25-35-36(32,33)34-23-22-29(2,3)4/h26,30H,5-25H2,1-4H3,(H-,28,31,32,33)