ethyl 4-methyl-3-[4-(trifluoromethyl)phenyl]-1H-pyrazole-5-carboxylate

Systemtic Name: ethyl 4-methyl-3-[4-(trifluoromethyl)phenyl]-1H-pyrazole-5-carboxylate Openeye Name: ethyl 4-methyl-3-[4-(trifluoromethyl)phenyl]-1H-pyrazole-5-carboxylate CAS Name: 4-methyl-3-[4-(trifluoromethyl)phenyl]-1H-pyrazole-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-3-[4-(trifluoromethyl)phenyl]-1H-pyrazole-5-carboxylate Traditional Name: 4-methyl-3-[4-(trifluoromethyl)phenyl]-1H-pyrazole-5-carboxylic acid ethyl ester Formula: C14H13F3N2O2 MolecularWeight: 298.26043

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=NN1)C2=CC=C(C=C2)C(F)(F)F)C

Isomeric SMILES

CCOC(=O)C1=C(C(=NN1)C2=CC=C(C=C2)C(F)(F)F)C

InChI

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