[3-octadecoxy-2-(1,2-oxazol-3-yloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: [3-octadecoxy-2-(1,2-oxazol-3-yloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: (2-isoxazol-3-yloxy-3-octadecoxy-propyl) 2-(trimethylammonio)ethyl phosphate CAS Name: [2-(3-isoxazolyloxy)-3-octadecoxypropyl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: [3-octadecoxy-2-(1,2-oxazol-3-yloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: (2-isoxazol-3-yloxy-3-stearyloxy-propyl) 2-(trimethylammonio)ethyl phosphate Formula: C29H57N2O7P MolecularWeight: 576.745841

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCC(COP(=O)([O-])OCC[N+](C)(C)C)OC1=NOC=C1

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCC(COP(=O)([O-])OCC[N+](C)(C)C)OC1=NOC=C1

InChI

InChI=1S/C29H57N2O7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23-34-26-28(38-29-21-24-35-30-29)27-37-39(32,33)36-25-22-31(2,3)4/h21,24,28H,5-20,22-23,25-27H2,1-4H3