trimethyl-[2-[2-(3-octadecoxy-2-oxidanyl-propoxy)ethoxy]ethyl]azanium chloride

Systemtic Name: trimethyl-[2-[2-(3-octadecoxy-2-oxidanyl-propoxy)ethoxy]ethyl]azanium chloride Openeye Name: 2-[2-(2-hydroxy-3-octadecoxy-propoxy)ethoxy]ethyl-trimethyl-ammonium chloride CAS Name: 2-[2-(2-hydroxy-3-octadecoxypropoxy)ethoxy]ethyl-trimethylammonium chloride IUPAC Name: 2-[2-(2-hydroxy-3-octadecoxypropoxy)ethoxy]ethyl-trimethylazanium chloride Traditional Name: 2-[2-(2-hydroxy-3-stearyloxy-propoxy)ethoxy]ethyl-trimethyl-ammonium chloride Formula: C28H60ClNO4 MolecularWeight: 510.2333

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCC(COCCOCC[N+](C)(C)C)O.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCC(COCCOCC[N+](C)(C)C)O.[Cl-]

InChI

InChI=1S/C28H60NO4.ClH/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22-32-26-28(30)27-33-25-24-31-23-21-29(2,3)4;/h28,30H,5-27H2,1-4H3;1H/q+1;/p-1