2-[5-oxidanylidene-1-[3-(trifluoromethyl)phenyl]-4H-pyrazol-3-yl]ethanoic acid

Systemtic Name: 2-[5-oxidanylidene-1-[3-(trifluoromethyl)phenyl]-4H-pyrazol-3-yl]ethanoic acid Openeye Name: 2-[5-oxo-1-[3-(trifluoromethyl)phenyl]-4H-pyrazol-3-yl]acetic acid CAS Name: 2-[5-oxo-1-[3-(trifluoromethyl)phenyl]-4H-pyrazol-3-yl]acetic acid IUPAC Name: 2-[5-oxo-1-[3-(trifluoromethyl)phenyl]-4H-pyrazol-3-yl]acetic acid Traditional Name: 2-[5-keto-1-[3-(trifluoromethyl)phenyl]-2-pyrazolin-3-yl]acetic acid Formula: C12H9F3N2O3 MolecularWeight: 286.20667

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=NN(C1=O)C2=CC=CC(=C2)C(F)(F)F)CC(=O)O

Isomeric SMILES

C1C(=NN(C1=O)C2=CC=CC(=C2)C(F)(F)F)CC(=O)O

InChI

InChI=1S/C12H9F3N2O3/c13-12(14,15)7-2-1-3-9(4-7)17-10(18)5-8(16-17)6-11(19)20/h1-4H,5-6H2,(H,19,20)