2-[4-[2-(4-fluorophenyl)ethynyl]-2-methyl-5-(trifluoromethyl)pyrazol-3-yl]ethanoic acid

Systemtic Name: 2-[4-[2-(4-fluorophenyl)ethynyl]-2-methyl-5-(trifluoromethyl)pyrazol-3-yl]ethanoic acid Openeye Name: 2-[4-[2-(4-fluorophenyl)ethynyl]-2-methyl-5-(trifluoromethyl)pyrazol-3-yl]acetic acid CAS Name: 2-[4-[2-(4-fluorophenyl)ethynyl]-2-methyl-5-(trifluoromethyl)-3-pyrazolyl]acetic acid IUPAC Name: 2-[4-[2-(4-fluorophenyl)ethynyl]-2-methyl-5-(trifluoromethyl)pyrazol-3-yl]acetic acid Traditional Name: 2-[4-[2-(4-fluorophenyl)ethynyl]-2-methyl-5-(trifluoromethyl)pyrazol-3-yl]acetic acid Formula: C15H10F4N2O2 MolecularWeight: 326.245713

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=N1)C(F)(F)F)C#CC2=CC=C(C=C2)F)CC(=O)O

Isomeric SMILES

CN1C(=C(C(=N1)C(F)(F)F)C#CC2=CC=C(C=C2)F)CC(=O)O

InChI

InChI=1S/C15H10F4N2O2/c1-21-12(8-13(22)23)11(14(20-21)15(17,18)19)7-4-9-2-5-10(16)6-3-9/h2-3,5-6H,8H2,1H3,(H,22,23)