ethyl 2-(3-cyano-4-fluoranyl-phenyl)-5-(trifluoromethyl)pyrazole-3-carboxylate

Systemtic Name: ethyl 2-(3-cyano-4-fluoranyl-phenyl)-5-(trifluoromethyl)pyrazole-3-carboxylate Openeye Name: ethyl 2-(3-cyano-4-fluoro-phenyl)-5-(trifluoromethyl)pyrazole-3-carboxylate CAS Name: 2-(3-cyano-4-fluorophenyl)-5-(trifluoromethyl)-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(3-cyano-4-fluorophenyl)-5-(trifluoromethyl)pyrazole-3-carboxylate Traditional Name: 2-(3-cyano-4-fluoro-phenyl)-5-(trifluoromethyl)pyrazole-3-carboxylic acid ethyl ester Formula: C14H9F4N3O2 MolecularWeight: 327.233773

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=NN1C2=CC(=C(C=C2)F)C#N)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=CC(=NN1C2=CC(=C(C=C2)F)C#N)C(F)(F)F

InChI

InChI=1S/C14H9F4N3O2/c1-2-23-13(22)11-6-12(14(16,17)18)20-21(11)9-3-4-10(15)8(5-9)7-19/h3-6H,2H2,1H3