(1-oxidanylidene-1-phenyl-propan-2-yl) 4-methoxy-1-[3-(trifluoromethyl)phenyl]pyrazole-3-carboxylate

Systemtic Name: (1-oxidanylidene-1-phenyl-propan-2-yl) 4-methoxy-1-[3-(trifluoromethyl)phenyl]pyrazole-3-carboxylate Openeye Name: (1-methyl-2-oxo-2-phenyl-ethyl) 4-methoxy-1-[3-(trifluoromethyl)phenyl]pyrazole-3-carboxylate CAS Name: 4-methoxy-1-[3-(trifluoromethyl)phenyl]-3-pyrazolecarboxylic acid (1-oxo-1-phenylpropan-2-yl) ester IUPAC Name: (1-oxo-1-phenylpropan-2-yl) 4-methoxy-1-[3-(trifluoromethyl)phenyl]pyrazole-3-carboxylate Traditional Name: 4-methoxy-1-[3-(trifluoromethyl)phenyl]pyrazole-3-carboxylic acid (2-keto-1-methyl-2-phenyl-ethyl) ester Formula: C21H17F3N2O4 MolecularWeight: 418.36589

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=CC=C1)OC(=O)C2=NN(C=C2OC)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CC(C(=O)C1=CC=CC=C1)OC(=O)C2=NN(C=C2OC)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C21H17F3N2O4/c1-13(19(27)14-7-4-3-5-8-14)30-20(28)18-17(29-2)12-26(25-18)16-10-6-9-15(11-16)21(22,23)24/h3-13H,1-2H3