methyl (2S)-4-oxidanylidene-2-[2,2,2-tris(fluoranyl)ethanoylamino]butanoate

Systemtic Name: methyl (2S)-4-oxidanylidene-2-[2,2,2-tris(fluoranyl)ethanoylamino]butanoate Openeye Name: methyl (2S)-4-oxo-2-[(2,2,2-trifluoroacetyl)amino]butanoate CAS Name: (2S)-4-oxo-2-[(2,2,2-trifluoro-1-oxoethyl)amino]butanoic acid methyl ester IUPAC Name: methyl (2S)-4-oxo-2-[(2,2,2-trifluoroacetyl)amino]butanoate Traditional Name: (2S)-4-keto-2-[(2,2,2-trifluoroacetyl)amino]butyric acid methyl ester Formula: C7H8F3NO4 MolecularWeight: 227.13793

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC=O)NC(=O)C(F)(F)F

Isomeric SMILES

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

InChI

InChI=1S/C7H8F3NO4/c1-15-5(13)4(2-3-12)11-6(14)7(8,9)10/h3-4H,2H2,1H3,(H,11,14)/t4-/m0/s1