[3-octadecanoyloxy-2-(2-propylnonoxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: [3-octadecanoyloxy-2-(2-propylnonoxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: [3-octadecanoyloxy-2-(2-propylnonoxy)propyl] 2-(trimethylammonio)ethyl phosphate CAS Name: [3-(1-oxooctadecoxy)-2-(2-propylnonoxy)propyl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: [3-octadecanoyloxy-2-(2-propylnonoxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: [2-(2-propylnonoxy)-3-stearoyloxy-propyl] 2-(trimethylammonio)ethyl phosphate Formula: C38H78NO7P MolecularWeight: 692.002181

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)OCC(CCC)CCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)OCC(CCC)CCCCCCC

InChI

InChI=1S/C38H78NO7P/c1-7-10-12-14-15-16-17-18-19-20-21-22-23-25-27-30-38(40)44-34-37(35-46-47(41,42)45-32-31-39(4,5)6)43-33-36(28-9-3)29-26-24-13-11-8-2/h36-37H,7-35H2,1-6H3