[3-(dodecanoylamino)-2-heptoxy-propyl] 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: [3-(dodecanoylamino)-2-heptoxy-propyl] 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: [3-(dodecanoylamino)-2-heptoxy-propyl] 2-(trimethylammonio)ethyl phosphate CAS Name: [2-heptoxy-3-(1-oxododecylamino)propyl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: [3-(dodecanoylamino)-2-heptoxypropyl] 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: [2-heptoxy-3-(lauroylamino)propyl] 2-(trimethylammonio)ethyl phosphate Formula: C27H57N2O6P MolecularWeight: 536.725041

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)NCC(COP(=O)([O-])OCC[N+](C)(C)C)OCCCCCCC

Isomeric SMILES

CCCCCCCCCCCC(=O)NCC(COP(=O)([O-])OCC[N+](C)(C)C)OCCCCCCC

InChI

InChI=1S/C27H57N2O6P/c1-6-8-10-12-13-14-15-16-18-20-27(30)28-24-26(33-22-19-17-11-9-7-2)25-35-36(31,32)34-23-21-29(3,4)5/h26H,6-25H2,1-5H3,(H-,28,30,31,32)