[2-(3-methylphenyl)-5-(trifluoromethyl)pyrazol-3-yl] 4-ethylbenzoate

Systemtic Name: [2-(3-methylphenyl)-5-(trifluoromethyl)pyrazol-3-yl] 4-ethylbenzoate Openeye Name: [2-(m-tolyl)-5-(trifluoromethyl)pyrazol-3-yl] 4-ethylbenzoate CAS Name: 4-ethylbenzoic acid [2-(3-methylphenyl)-5-(trifluoromethyl)-3-pyrazolyl] ester IUPAC Name: [2-(3-methylphenyl)-5-(trifluoromethyl)pyrazol-3-yl] 4-ethylbenzoate Traditional Name: 4-ethylbenzoic acid [2-(m-tolyl)-5-(trifluoromethyl)pyrazol-3-yl] ester Formula: C20H17F3N2O2 MolecularWeight: 374.35639

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)OC2=CC(=NN2C3=CC=CC(=C3)C)C(F)(F)F

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)OC2=CC(=NN2C3=CC=CC(=C3)C)C(F)(F)F

InChI

InChI=1S/C20H17F3N2O2/c1-3-14-7-9-15(10-8-14)19(26)27-18-12-17(20(21,22)23)24-25(18)16-6-4-5-13(2)11-16/h4-12H,3H2,1-2H3