[(2R)-1-oxidanylidene-1-[[2-(trifluoromethyl)phenyl]amino]propan-2-yl] 1-oxidanylidene-2H-isoquinoline-3-carboxylate

Systemtic Name: [(2R)-1-oxidanylidene-1-[[2-(trifluoromethyl)phenyl]amino]propan-2-yl] 1-oxidanylidene-2H-isoquinoline-3-carboxylate Openeye Name: [(1R)-1-methyl-2-oxo-2-[2-(trifluoromethyl)anilino]ethyl] 1-oxo-2H-isoquinoline-3-carboxylate CAS Name: 1-oxo-2H-isoquinoline-3-carboxylic acid [(2R)-1-oxo-1-[2-(trifluoromethyl)anilino]propan-2-yl] ester IUPAC Name: [(2R)-1-oxo-1-[2-(trifluoromethyl)anilino]propan-2-yl] 1-oxo-2H-isoquinoline-3-carboxylate Traditional Name: 1-keto-2H-isoquinoline-3-carboxylic acid [(1R)-2-keto-1-methyl-2-[2-(trifluoromethyl)anilino]ethyl] ester Formula: C20H15F3N2O4 MolecularWeight: 404.33931

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1C(F)(F)F)OC(=O)C2=CC3=CC=CC=C3C(=O)N2

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC=C1C(F)(F)F)OC(=O)C2=CC3=CC=CC=C3C(=O)N2

InChI

InChI=1S/C20H15F3N2O4/c1-11(17(26)24-15-9-5-4-8-14(15)20(21,22)23)29-19(28)16-10-12-6-2-3-7-13(12)18(27)25-16/h2-11H,1H3,(H,24,26)(H,25,27)/t11-/m1/s1