[(2R)-1-oxidanylidene-1-[[4-(trifluoromethyl)phenyl]amino]propan-2-yl] quinoline-2-carboxylate

Systemtic Name: [(2R)-1-oxidanylidene-1-[[4-(trifluoromethyl)phenyl]amino]propan-2-yl] quinoline-2-carboxylate Openeye Name: [(1R)-1-methyl-2-oxo-2-[4-(trifluoromethyl)anilino]ethyl] quinoline-2-carboxylate CAS Name: 2-quinolinecarboxylic acid [(2R)-1-oxo-1-[4-(trifluoromethyl)anilino]propan-2-yl] ester IUPAC Name: [(2R)-1-oxo-1-[4-(trifluoromethyl)anilino]propan-2-yl] quinoline-2-carboxylate Traditional Name: quinaldic acid [(1R)-2-keto-1-methyl-2-[4-(trifluoromethyl)anilino]ethyl] ester Formula: C20H15F3N2O3 MolecularWeight: 388.33991

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)C(F)(F)F)OC(=O)C2=NC3=CC=CC=C3C=C2

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)C(F)(F)F)OC(=O)C2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C20H15F3N2O3/c1-12(18(26)24-15-9-7-14(8-10-15)20(21,22)23)28-19(27)17-11-6-13-4-2-3-5-16(13)25-17/h2-12H,1H3,(H,24,26)/t12-/m1/s1