[(2S)-4,4,5-trimethyl-1-oxidanyl-1-oxidanylidene-hexan-2-yl]azanium chloride

Systemtic Name: [(2S)-4,4,5-trimethyl-1-oxidanyl-1-oxidanylidene-hexan-2-yl]azanium chloride Openeye Name: [(1S)-1-carboxy-3,3,4-trimethyl-pentyl]ammonium chloride CAS Name: [(2S)-1-hydroxy-4,4,5-trimethyl-1-oxohexan-2-yl]ammonium chloride IUPAC Name: [(2S)-1-hydroxy-4,4,5-trimethyl-1-oxohexan-2-yl]azanium chloride Traditional Name: [(1S)-1-carboxy-3,3,4-trimethyl-pentyl]ammonium chloride Formula: C9H20ClNO2 MolecularWeight: 209.7136

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)(C)CC(C(=O)O)[NH3+].[Cl-]

Isomeric SMILES

CC(C)C(C)(C)C[C@@H](C(=O)O)[NH3+].[Cl-]

InChI

InChI=1S/C9H19NO2.ClH/c1-6(2)9(3,4)5-7(10)8(11)12;/h6-7H,5,10H2,1-4H3,(H,11,12);1H/t7-;/m0./s1