methyl 3-methyl-1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxylate

Systemtic Name: methyl 3-methyl-1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxylate Openeye Name: methyl 3-methyl-1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxylate CAS Name: 3-methyl-1-phenyl-5-(trifluoromethyl)-4-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 3-methyl-1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxylate Traditional Name: 3-methyl-1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxylic acid methyl ester Formula: C13H11F3N2O2 MolecularWeight: 284.23385

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)OC)C(F)(F)F)C2=CC=CC=C2

Isomeric SMILES

CC1=NN(C(=C1C(=O)OC)C(F)(F)F)C2=CC=CC=C2

InChI

InChI=1S/C13H11F3N2O2/c1-8-10(12(19)20-2)11(13(14,15)16)18(17-8)9-6-4-3-5-7-9/h3-7H,1-2H3