[2-(8-azanyloctanoyloxy)-3-octadecanoyloxy-propyl] 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: [2-(8-azanyloctanoyloxy)-3-octadecanoyloxy-propyl] 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: [2-(8-aminooctanoyloxy)-3-octadecanoyloxy-propyl] 2-(trimethylammonio)ethyl phosphate CAS Name: [2-(8-amino-1-oxooctoxy)-3-(1-oxooctadecoxy)propyl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: [2-(8-aminooctanoyloxy)-3-octadecanoyloxypropyl] 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: [2-(8-aminooctanoyloxy)-3-stearoyloxy-propyl] 2-(trimethylammonio)ethyl phosphate Formula: C34H69N2O8P MolecularWeight: 664.894021

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCN

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCN

InChI

InChI=1S/C34H69N2O8P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-19-22-25-33(37)41-30-32(44-34(38)26-23-20-18-21-24-27-35)31-43-45(39,40)42-29-28-36(2,3)4/h32H,5-31,35H2,1-4H3