ethyl (2S)-4-[(4-ethylphenyl)amino]-2-oxidanyl-4-oxidanylidene-2-(trifluoromethyl)butanoate

Systemtic Name: ethyl (2S)-4-[(4-ethylphenyl)amino]-2-oxidanyl-4-oxidanylidene-2-(trifluoromethyl)butanoate Openeye Name: ethyl (2S)-4-(4-ethylanilino)-2-hydroxy-4-oxo-2-(trifluoromethyl)butanoate CAS Name: (2S)-4-(4-ethylanilino)-2-hydroxy-4-oxo-2-(trifluoromethyl)butanoic acid ethyl ester IUPAC Name: ethyl (2S)-4-(4-ethylanilino)-2-hydroxy-4-oxo-2-(trifluoromethyl)butanoate Traditional Name: (2S)-4-(4-ethylanilino)-2-hydroxy-4-keto-2-(trifluoromethyl)butyric acid ethyl ester Formula: C15H18F3NO4 MolecularWeight: 333.30293

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)CC(C(=O)OCC)(C(F)(F)F)O

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C[C@](C(=O)OCC)(C(F)(F)F)O

InChI

InChI=1S/C15H18F3NO4/c1-3-10-5-7-11(8-6-10)19-12(20)9-14(22,15(16,17)18)13(21)23-4-2/h5-8,22H,3-4,9H2,1-2H3,(H,19,20)/t14-/m0/s1