trimethyl-[(2R)-2-(3-methylbutanoyloxy)-4-oxidanyl-4-oxidanylidene-butyl]azanium chloride

Systemtic Name: trimethyl-[(2R)-2-(3-methylbutanoyloxy)-4-oxidanyl-4-oxidanylidene-butyl]azanium chloride Openeye Name: [(2R)-4-hydroxy-2-(3-methylbutanoyloxy)-4-oxo-butyl]-trimethyl-ammonium chloride CAS Name: [(2R)-4-hydroxy-2-(3-methyl-1-oxobutoxy)-4-oxobutyl]-trimethylammonium chloride IUPAC Name: [(2R)-4-hydroxy-2-(3-methylbutanoyloxy)-4-oxobutyl]-trimethylazanium chloride Traditional Name: [(2R)-4-hydroxy-2-isovaleryloxy-4-keto-butyl]-trimethyl-ammonium chloride Formula: C12H24ClNO4 MolecularWeight: 281.77626

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)CC(=O)O[C@H](CC(=O)O)C[N+](C)(C)C.[Cl-]

InChI

InChI=1S/C12H23NO4.ClH/c1-9(2)6-12(16)17-10(7-11(14)15)8-13(3,4)5;/h9-10H,6-8H2,1-5H3;1H/t10-;/m1./s1