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

Systemtic Name: [4-(trifluoromethyl)phenyl] 5-tert-butyl-2-methyl-pyrazole-3-carboxylate Openeye Name: [4-(trifluoromethyl)phenyl] 5-tert-butyl-2-methyl-pyrazole-3-carboxylate CAS Name: 5-tert-butyl-2-methyl-3-pyrazolecarboxylic acid [4-(trifluoromethyl)phenyl] ester IUPAC Name: [4-(trifluoromethyl)phenyl] 5-tert-butyl-2-methylpyrazole-3-carboxylate Traditional Name: 5-tert-butyl-2-methyl-pyrazole-3-carboxylic acid [4-(trifluoromethyl)phenyl] ester Formula: C16H17F3N2O2 MolecularWeight: 326.31359

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)C(=O)OC2=CC=C(C=C2)C(F)(F)F)C

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)C(=O)OC2=CC=C(C=C2)C(F)(F)F)C

InChI

InChI=1S/C16H17F3N2O2/c1-15(2,3)13-9-12(21(4)20-13)14(22)23-11-7-5-10(6-8-11)16(17,18)19/h5-9H,1-4H3