2-[2-[3-hexadecoxy-2-(3-oxidanylidenebutanoyloxy)propoxy]ethoxy]ethyl-trimethyl-azanium chloride

Systemtic Name: 2-[2-[3-hexadecoxy-2-(3-oxidanylidenebutanoyloxy)propoxy]ethoxy]ethyl-trimethyl-azanium chloride Openeye Name: 2-[2-[3-hexadecoxy-2-(3-oxobutanoyloxy)propoxy]ethoxy]ethyl-trimethyl-ammonium chloride CAS Name: 2-[2-[2-(1,3-dioxobutoxy)-3-hexadecoxypropoxy]ethoxy]ethyl-trimethylammonium chloride IUPAC Name: 2-[2-[3-hexadecoxy-2-(3-oxobutanoyloxy)propoxy]ethoxy]ethyl-trimethylazanium chloride Traditional Name: 2-[2-(2-acetoacetyloxy-3-cetyloxy-propoxy)ethoxy]ethyl-trimethyl-ammonium chloride Formula: C30H60ClNO6 MolecularWeight: 566.2535

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCC(COCCOCC[N+](C)(C)C)OC(=O)CC(=O)C.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCCOCC(COCCOCC[N+](C)(C)C)OC(=O)CC(=O)C.[Cl-]

InChI

InChI=1S/C30H60NO6.ClH/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-35-26-29(37-30(33)25-28(2)32)27-36-24-23-34-22-20-31(3,4)5;/h29H,6-27H2,1-5H3;1H/q+1;/p-1