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

Systemtic Name: (2S)-3-methyl-2-[[3-(trifluoromethyl)phenyl]carbonylamino]butanoate Openeye Name: (2S)-3-methyl-2-[[3-(trifluoromethyl)benzoyl]amino]butanoate CAS Name: (2S)-3-methyl-2-[[oxo-[3-(trifluoromethyl)phenyl]methyl]amino]butanoate IUPAC Name: (2S)-3-methyl-2-[[3-(trifluoromethyl)benzoyl]amino]butanoate Traditional Name: (2S)-3-methyl-2-[[3-(trifluoromethyl)benzoyl]amino]butyrate Formula: C13H13F3NO3- MolecularWeight: 288.24243

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)[O-])NC(=O)C1=CC(=CC=C1)C(F)(F)F

Isomeric SMILES

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

InChI

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