ethyl 1-[4-(trifluoromethyl)phenyl]pyrazole-4-carboxylate

Systemtic Name: ethyl 1-[4-(trifluoromethyl)phenyl]pyrazole-4-carboxylate Openeye Name: ethyl 1-[4-(trifluoromethyl)phenyl]pyrazole-4-carboxylate CAS Name: 1-[4-(trifluoromethyl)phenyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-(trifluoromethyl)phenyl]pyrazole-4-carboxylate Traditional Name: 1-[4-(trifluoromethyl)phenyl]pyrazole-4-carboxylic acid ethyl ester Formula: C13H11F3N2O2 MolecularWeight: 284.23385

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H11F3N2O2/c1-2-20-12(19)9-7-17-18(8-9)11-5-3-10(4-6-11)13(14,15)16/h3-8H,2H2,1H3