[2-phenyl-5-(trifluoromethyl)pyrazol-3-yl] 4-methylbenzoate

Systemtic Name: [2-phenyl-5-(trifluoromethyl)pyrazol-3-yl] 4-methylbenzoate Openeye Name: [2-phenyl-5-(trifluoromethyl)pyrazol-3-yl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [2-phenyl-5-(trifluoromethyl)-3-pyrazolyl] ester IUPAC Name: [2-phenyl-5-(trifluoromethyl)pyrazol-3-yl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [2-phenyl-5-(trifluoromethyl)pyrazol-3-yl] ester Formula: C18H13F3N2O2 MolecularWeight: 346.30323

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC2=CC(=NN2C3=CC=CC=C3)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OC2=CC(=NN2C3=CC=CC=C3)C(F)(F)F

InChI

InChI=1S/C18H13F3N2O2/c1-12-7-9-13(10-8-12)17(24)25-16-11-15(18(19,20)21)22-23(16)14-5-3-2-4-6-14/h2-11H,1H3