[3-(icosanoylamino)-2-nonoxy-propyl] 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: [3-(icosanoylamino)-2-nonoxy-propyl] 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: [3-(icosanoylamino)-2-nonoxy-propyl] 2-(trimethylammonio)ethyl phosphate CAS Name: [2-nonoxy-3-(1-oxoeicosylamino)propyl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: [3-(icosanoylamino)-2-nonoxypropyl] 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: [3-(eicosanoylamino)-2-nonoxy-propyl] 2-(trimethylammonio)ethyl phosphate Formula: C37H77N2O6P MolecularWeight: 676.990841

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCC(=O)NCC(COP(=O)([O-])OCC[N+](C)(C)C)OCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCC(=O)NCC(COP(=O)([O-])OCC[N+](C)(C)C)OCCCCCCCCC

InChI

InChI=1S/C37H77N2O6P/c1-6-8-10-12-14-15-16-17-18-19-20-21-22-23-24-26-28-30-37(40)38-34-36(43-32-29-27-25-13-11-9-7-2)35-45-46(41,42)44-33-31-39(3,4)5/h36H,6-35H2,1-5H3,(H-,38,40,41,42)