[4-cyano-2-methyl-5-(trifluoromethyl)pyrazol-3-yl] 4-fluoranylbenzoate

Systemtic Name: [4-cyano-2-methyl-5-(trifluoromethyl)pyrazol-3-yl] 4-fluoranylbenzoate Openeye Name: [4-cyano-2-methyl-5-(trifluoromethyl)pyrazol-3-yl] 4-fluorobenzoate CAS Name: 4-fluorobenzoic acid [4-cyano-2-methyl-5-(trifluoromethyl)-3-pyrazolyl] ester IUPAC Name: [4-cyano-2-methyl-5-(trifluoromethyl)pyrazol-3-yl] 4-fluorobenzoate Traditional Name: 4-fluorobenzoic acid [4-cyano-2-methyl-5-(trifluoromethyl)pyrazol-3-yl] ester Formula: C13H7F4N3O2 MolecularWeight: 313.207193

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=N1)C(F)(F)F)C#N)OC(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CN1C(=C(C(=N1)C(F)(F)F)C#N)OC(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C13H7F4N3O2/c1-20-11(9(6-18)10(19-20)13(15,16)17)22-12(21)7-2-4-8(14)5-3-7/h2-5H,1H3