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

Systemtic Name: 2-chloranyl-5-[5-oxidanylidene-3-(trifluoromethyl)-4H-pyrazol-1-yl]benzoic acid Openeye Name: 2-chloro-5-[5-oxo-3-(trifluoromethyl)-4H-pyrazol-1-yl]benzoic acid CAS Name: 2-chloro-5-[5-oxo-3-(trifluoromethyl)-4H-pyrazol-1-yl]benzoic acid IUPAC Name: 2-chloro-5-[5-oxo-3-(trifluoromethyl)-4H-pyrazol-1-yl]benzoic acid Traditional Name: 2-chloro-5-[5-keto-3-(trifluoromethyl)-2-pyrazolin-1-yl]benzoic acid Formula: C11H6ClF3N2O3 MolecularWeight: 306.62515

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H6ClF3N2O3/c12-7-2-1-5(3-6(7)10(19)20)17-9(18)4-8(16-17)11(13,14)15/h1-3H,4H2,(H,19,20)