3-(3,5-dimethylpyrazol-1-yl)-4-fluoranyl-benzoate

Systemtic Name: 3-(3,5-dimethylpyrazol-1-yl)-4-fluoranyl-benzoate Openeye Name: 3-(3,5-dimethylpyrazol-1-yl)-4-fluoro-benzoate CAS Name: 3-(3,5-dimethyl-1-pyrazolyl)-4-fluorobenzoate IUPAC Name: 3-(3,5-dimethylpyrazol-1-yl)-4-fluorobenzoate Traditional Name: 3-(3,5-dimethylpyrazol-1-yl)-4-fluoro-benzoate Formula: C12H10FN2O2- MolecularWeight: 233.218403

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=C(C=CC(=C2)C(=O)[O-])F)C

Isomeric SMILES

CC1=CC(=NN1C2=C(C=CC(=C2)C(=O)[O-])F)C

InChI

InChI=1S/C12H11FN2O2/c1-7-5-8(2)15(14-7)11-6-9(12(16)17)3-4-10(11)13/h3-6H,1-2H3,(H,16,17)/p-1