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

Systemtic Name: [2-(3-methylphenyl)-5-(trifluoromethyl)pyrazol-3-yl] 3-methylbutanoate Openeye Name: [2-(m-tolyl)-5-(trifluoromethyl)pyrazol-3-yl] 3-methylbutanoate CAS Name: 3-methylbutanoic acid [2-(3-methylphenyl)-5-(trifluoromethyl)-3-pyrazolyl] ester IUPAC Name: [2-(3-methylphenyl)-5-(trifluoromethyl)pyrazol-3-yl] 3-methylbutanoate Traditional Name: 3-methylbutyric acid [2-(m-tolyl)-5-(trifluoromethyl)pyrazol-3-yl] ester Formula: C16H17F3N2O2 MolecularWeight: 326.31359

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=CC(=N2)C(F)(F)F)OC(=O)CC(C)C

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=CC(=N2)C(F)(F)F)OC(=O)CC(C)C

InChI

InChI=1S/C16H17F3N2O2/c1-10(2)7-15(22)23-14-9-13(16(17,18)19)20-21(14)12-6-4-5-11(3)8-12/h4-6,8-10H,7H2,1-3H3