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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(N=C1)CC2=CC(=CC=C2)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=CN(N=C1)CC2=CC(=CC=C2)C(F)(F)F

InChI

InChI=1S/C14H13F3N2O2/c1-2-21-13(20)11-7-18-19(9-11)8-10-4-3-5-12(6-10)14(15,16)17/h3-7,9H,2,8H2,1H3