ethyl 5-methyl-2-[4-(trifluoromethyl)phenyl]pyrazole-3-carboxylate

Systemtic Name: ethyl 5-methyl-2-[4-(trifluoromethyl)phenyl]pyrazole-3-carboxylate Openeye Name: ethyl 5-methyl-2-[4-(trifluoromethyl)phenyl]pyrazole-3-carboxylate CAS Name: 5-methyl-2-[4-(trifluoromethyl)phenyl]-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-2-[4-(trifluoromethyl)phenyl]pyrazole-3-carboxylate Traditional Name: 5-methyl-2-[4-(trifluoromethyl)phenyl]pyrazole-3-carboxylic acid ethyl ester Formula: C14H13F3N2O2 MolecularWeight: 298.26043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13F3N2O2/c1-3-21-13(20)12-8-9(2)18-19(12)11-6-4-10(5-7-11)14(15,16)17/h4-8H,3H2,1-2H3