[2-methyl-5-(trifluoromethyl)pyrazol-3-yl] 4-tert-butylbenzoate

Systemtic Name: [2-methyl-5-(trifluoromethyl)pyrazol-3-yl] 4-tert-butylbenzoate Openeye Name: [2-methyl-5-(trifluoromethyl)pyrazol-3-yl] 4-tert-butylbenzoate CAS Name: 4-tert-butylbenzoic acid [2-methyl-5-(trifluoromethyl)-3-pyrazolyl] ester IUPAC Name: [2-methyl-5-(trifluoromethyl)pyrazol-3-yl] 4-tert-butylbenzoate Traditional Name: 4-tert-butylbenzoic acid [2-methyl-5-(trifluoromethyl)pyrazol-3-yl] ester Formula: C16H17F3N2O2 MolecularWeight: 326.31359

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)OC2=CC(=NN2C)C(F)(F)F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)OC2=CC(=NN2C)C(F)(F)F

InChI

InChI=1S/C16H17F3N2O2/c1-15(2,3)11-7-5-10(6-8-11)14(22)23-13-9-12(16(17,18)19)20-21(13)4/h5-9H,1-4H3