(2-hexanoyloxy-4-oxidanyl-4-oxidanylidene-butyl)-trimethyl-azanium hydrochloride

Systemtic Name: (2-hexanoyloxy-4-oxidanyl-4-oxidanylidene-butyl)-trimethyl-azanium hydrochloride Openeye Name: (2-hexanoyloxy-4-hydroxy-4-oxo-butyl)-trimethyl-ammonium hydrochloride CAS Name: [4-hydroxy-4-oxo-2-(1-oxohexoxy)butyl]-trimethylammonium hydrochloride IUPAC Name: (2-hexanoyloxy-4-hydroxy-4-oxobutyl)-trimethylazanium hydrochloride Traditional Name: (2-caproyloxy-4-hydroxy-4-keto-butyl)-trimethyl-ammonium hydrochloride Formula: C13H27ClNO4+ MolecularWeight: 296.81078

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)OC(CC(=O)O)C[N+](C)(C)C.Cl

Isomeric SMILES

CCCCCC(=O)OC(CC(=O)O)C[N+](C)(C)C.Cl

InChI

InChI=1S/C13H25NO4.ClH/c1-5-6-7-8-13(17)18-11(9-12(15)16)10-14(2,3)4;/h11H,5-10H2,1-4H3;1H/p+1