ethyl 5-tert-butyl-2-[(4-fluorophenyl)methyl]pyrazole-3-carboxylate

Systemtic Name: ethyl 5-tert-butyl-2-[(4-fluorophenyl)methyl]pyrazole-3-carboxylate Openeye Name: ethyl 5-tert-butyl-2-[(4-fluorophenyl)methyl]pyrazole-3-carboxylate CAS Name: 5-tert-butyl-2-[(4-fluorophenyl)methyl]-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-tert-butyl-2-[(4-fluorophenyl)methyl]pyrazole-3-carboxylate Traditional Name: 5-tert-butyl-2-(4-fluorobenzyl)pyrazole-3-carboxylic acid ethyl ester Formula: C17H21FN2O2 MolecularWeight: 304.359243

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=NN1CC2=CC=C(C=C2)F)C(C)(C)C

Isomeric SMILES

CCOC(=O)C1=CC(=NN1CC2=CC=C(C=C2)F)C(C)(C)C

InChI

InChI=1S/C17H21FN2O2/c1-5-22-16(21)14-10-15(17(2,3)4)19-20(14)11-12-6-8-13(18)9-7-12/h6-10H,5,11H2,1-4H3