2,2,2-tris(fluoranyl)-1-[5-(4-methylphenyl)-1H-pyrazol-4-yl]ethanone

Systemtic Name: 2,2,2-tris(fluoranyl)-1-[5-(4-methylphenyl)-1H-pyrazol-4-yl]ethanone Openeye Name: 2,2,2-trifluoro-1-[5-(p-tolyl)-1H-pyrazol-4-yl]ethanone CAS Name: 2,2,2-trifluoro-1-[5-(4-methylphenyl)-1H-pyrazol-4-yl]ethanone IUPAC Name: 2,2,2-trifluoro-1-[5-(4-methylphenyl)-1H-pyrazol-4-yl]ethanone Traditional Name: 2,2,2-trifluoro-1-[5-(p-tolyl)-1H-pyrazol-4-yl]ethanone Formula: C12H9F3N2O MolecularWeight: 254.20787

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C=NN2)C(=O)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C=NN2)C(=O)C(F)(F)F

InChI

InChI=1S/C12H9F3N2O/c1-7-2-4-8(5-3-7)10-9(6-16-17-10)11(18)12(13,14)15/h2-6H,1H3,(H,16,17)