[(2S)-2,4-bis(oxidanyl)-4-oxidanylidene-butyl]-trimethyl-azanium; 3-methylbutanoic acid

Systemtic Name: [(2S)-2,4-bis(oxidanyl)-4-oxidanylidene-butyl]-trimethyl-azanium; 3-methylbutanoic acid Openeye Name: [(2S)-2,4-dihydroxy-4-oxo-butyl]-trimethyl-ammonium; 3-methylbutanoic acid CAS Name: [(2S)-2,4-dihydroxy-4-oxobutyl]-trimethylammonium; 3-methylbutanoic acid IUPAC Name: [(2S)-2,4-dihydroxy-4-oxobutyl]-trimethylazanium; 3-methylbutanoic acid Traditional Name: [(2S)-2,4-dihydroxy-4-keto-butyl]-trimethyl-ammonium; 3-methylbutyric acid Formula: C12H26NO5+ MolecularWeight: 264.33854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)O.C[N+](C)(C)CC(CC(=O)O)O

Isomeric SMILES

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

InChI

InChI=1S/C7H15NO3.C5H10O2/c1-8(2,3)5-6(9)4-7(10)11;1-4(2)3-5(6)7/h6,9H,4-5H2,1-3H3;4H,3H2,1-2H3,(H,6,7)/p+1/t6-;/m0./s1