ethyl 1-(2-fluorophenyl)-5-(trifluoromethyl)pyrazole-4-carboxylate

Systemtic Name: ethyl 1-(2-fluorophenyl)-5-(trifluoromethyl)pyrazole-4-carboxylate Openeye Name: ethyl 1-(2-fluorophenyl)-5-(trifluoromethyl)pyrazole-4-carboxylate CAS Name: 1-(2-fluorophenyl)-5-(trifluoromethyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-fluorophenyl)-5-(trifluoromethyl)pyrazole-4-carboxylate Traditional Name: 1-(2-fluorophenyl)-5-(trifluoromethyl)pyrazole-4-carboxylic acid ethyl ester Formula: C13H10F4N2O2 MolecularWeight: 302.224313

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=CC=C2F)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=CC=C2F)C(F)(F)F

InChI

InChI=1S/C13H10F4N2O2/c1-2-21-12(20)8-7-18-19(11(8)13(15,16)17)10-6-4-3-5-9(10)14/h3-7H,2H2,1H3