4-[3-(trifluoromethyl)pyrazol-1-yl]benzoate

Systemtic Name: 4-[3-(trifluoromethyl)pyrazol-1-yl]benzoate Openeye Name: 4-[3-(trifluoromethyl)pyrazol-1-yl]benzoate CAS Name: 4-[3-(trifluoromethyl)-1-pyrazolyl]benzoate IUPAC Name: 4-[3-(trifluoromethyl)pyrazol-1-yl]benzoate Traditional Name: 4-[3-(trifluoromethyl)pyrazol-1-yl]benzoate Formula: C11H6F3N2O2- MolecularWeight: 255.17275

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)[O-])N2C=CC(=N2)C(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1C(=O)[O-])N2C=CC(=N2)C(F)(F)F

InChI

InChI=1S/C11H7F3N2O2/c12-11(13,14)9-5-6-16(15-9)8-3-1-7(2-4-8)10(17)18/h1-6H,(H,17,18)/p-1