[2-heptadecoxy-3-(tetradecanoylamino)propyl] 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: [2-heptadecoxy-3-(tetradecanoylamino)propyl] 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: [2-heptadecoxy-3-(tetradecanoylamino)propyl] 2-(trimethylammonio)ethyl phosphate CAS Name: [2-heptadecoxy-3-(1-oxotetradecylamino)propyl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: [2-heptadecoxy-3-(tetradecanoylamino)propyl] 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: [2-heptadecoxy-3-(tetradecanoylamino)propyl] 2-(trimethylammonio)ethyl phosphate Formula: C39H81N2O6P MolecularWeight: 705.044001

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCOC(CNC(=O)CCCCCCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCOC(CNC(=O)CCCCCCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C

InChI

InChI=1S/C39H81N2O6P/c1-6-8-10-12-14-16-18-19-20-21-23-25-27-29-31-34-45-38(37-47-48(43,44)46-35-33-41(3,4)5)36-40-39(42)32-30-28-26-24-22-17-15-13-11-9-7-2/h38H,6-37H2,1-5H3,(H-,40,42,43,44)