3-(3,5-dimethylpyrazol-1-yl)-4-fluoranyl-benzoic acid

Systemtic Name: 3-(3,5-dimethylpyrazol-1-yl)-4-fluoranyl-benzoic acid Openeye Name: 3-(3,5-dimethylpyrazol-1-yl)-4-fluoro-benzoic acid CAS Name: 3-(3,5-dimethyl-1-pyrazolyl)-4-fluorobenzoic acid IUPAC Name: 3-(3,5-dimethylpyrazol-1-yl)-4-fluorobenzoic acid Traditional Name: 3-(3,5-dimethylpyrazol-1-yl)-4-fluoro-benzoic acid Formula: C12H11FN2O2 MolecularWeight: 234.226343

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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)