[(2S)-1-oxidanylidene-1-[[3-(trifluoromethyl)phenyl]amino]propan-2-yl] 4-oxidanylbenzoate

Systemtic Name: [(2S)-1-oxidanylidene-1-[[3-(trifluoromethyl)phenyl]amino]propan-2-yl] 4-oxidanylbenzoate Openeye Name: [(1S)-1-methyl-2-oxo-2-[3-(trifluoromethyl)anilino]ethyl] 4-hydroxybenzoate CAS Name: 4-hydroxybenzoic acid [(2S)-1-oxo-1-[3-(trifluoromethyl)anilino]propan-2-yl] ester IUPAC Name: [(2S)-1-oxo-1-[3-(trifluoromethyl)anilino]propan-2-yl] 4-hydroxybenzoate Traditional Name: 4-hydroxybenzoic acid [(1S)-2-keto-1-methyl-2-[3-(trifluoromethyl)anilino]ethyl] ester Formula: C17H14F3NO4 MolecularWeight: 353.29257

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC(=C1)C(F)(F)F)OC(=O)C2=CC=C(C=C2)O

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=CC(=C1)C(F)(F)F)OC(=O)C2=CC=C(C=C2)O

InChI

InChI=1S/C17H14F3NO4/c1-10(25-16(24)11-5-7-14(22)8-6-11)15(23)21-13-4-2-3-12(9-13)17(18,19)20/h2-10,22H,1H3,(H,21,23)/t10-/m0/s1