(2S)-3-methyl-2-[[2-(trifluoromethyl)phenyl]carbonylamino]butanoic acid

Systemtic Name: (2S)-3-methyl-2-[[2-(trifluoromethyl)phenyl]carbonylamino]butanoic acid Openeye Name: (2S)-3-methyl-2-[[2-(trifluoromethyl)benzoyl]amino]butanoic acid CAS Name: (2S)-3-methyl-2-[[oxo-[2-(trifluoromethyl)phenyl]methyl]amino]butanoic acid IUPAC Name: (2S)-3-methyl-2-[[2-(trifluoromethyl)benzoyl]amino]butanoic acid Traditional Name: (2S)-3-methyl-2-[[2-(trifluoromethyl)benzoyl]amino]butyric acid Formula: C13H14F3NO3 MolecularWeight: 289.25037

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)C1=CC=CC=C1C(F)(F)F

Isomeric SMILES

CC(C)[C@@H](C(=O)O)NC(=O)C1=CC=CC=C1C(F)(F)F

InChI

InChI=1S/C13H14F3NO3/c1-7(2)10(12(19)20)17-11(18)8-5-3-4-6-9(8)13(14,15)16/h3-7,10H,1-2H3,(H,17,18)(H,19,20)/t10-/m0/s1