methyl-[(2S)-3-methyl-1-oxidanyl-1-oxidanylidene-butan-2-yl]azanium; 2,2,2-tris(fluoranyl)ethanoate

Systemtic Name: methyl-[(2S)-3-methyl-1-oxidanyl-1-oxidanylidene-butan-2-yl]azanium; 2,2,2-tris(fluoranyl)ethanoate Openeye Name: [(1S)-1-carboxy-2-methyl-propyl]-methyl-ammonium; 2,2,2-trifluoroacetate CAS Name: [(2S)-1-hydroxy-3-methyl-1-oxobutan-2-yl]-methylammonium; 2,2,2-trifluoroacetate IUPAC Name: [(2S)-1-hydroxy-3-methyl-1-oxobutan-2-yl]-methylazanium; 2,2,2-trifluoroacetate Traditional Name: [(1S)-1-carboxy-2-methyl-propyl]-methyl-ammonium; 2,2,2-trifluoroacetate Formula: C8H14F3NO4 MolecularWeight: 245.19627

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)[NH2+]C.C(=O)(C(F)(F)F)[O-]

Isomeric SMILES

CC(C)[C@@H](C(=O)O)[NH2+]C.C(=O)(C(F)(F)F)[O-]

InChI

InChI=1S/C6H13NO2.C2HF3O2/c1-4(2)5(7-3)6(8)9;3-2(4,5)1(6)7/h4-5,7H,1-3H3,(H,8,9);(H,6,7)/t5-;/m0./s1