3-methylbutanoate; trimethyl(1-oxidanylpropan-2-yl)azanium; hydrochloride

Systemtic Name: 3-methylbutanoate; trimethyl(1-oxidanylpropan-2-yl)azanium; hydrochloride Openeye Name: (2-hydroxy-1-methyl-ethyl)-trimethyl-ammonium; 3-methylbutanoate; hydrochloride CAS Name: 1-hydroxypropan-2-yl(trimethyl)ammonium; 3-methylbutanoate; hydrochloride IUPAC Name: 1-hydroxypropan-2-yl(trimethyl)azanium; 3-methylbutanoate; hydrochloride Traditional Name: (2-hydroxy-1-methyl-ethyl)-trimethyl-ammonium; 3-methylbutyrate; hydrochloride Formula: C11H26ClNO3 MolecularWeight: 255.78204

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H16NO.C5H10O2.ClH/c1-6(5-8)7(2,3)4;1-4(2)3-5(6)7;/h6,8H,5H2,1-4H3;4H,3H2,1-2H3,(H,6,7);1H/q+1;;/p-1