5-[4-bromanyl-1-methyl-5-(trifluoromethyl)pyrazol-3-yl]-2-chloranyl-4-fluoranyl-benzoate

Systemtic Name: 5-[4-bromanyl-1-methyl-5-(trifluoromethyl)pyrazol-3-yl]-2-chloranyl-4-fluoranyl-benzoate Openeye Name: 5-[4-bromo-1-methyl-5-(trifluoromethyl)pyrazol-3-yl]-2-chloro-4-fluoro-benzoate CAS Name: 5-[4-bromo-1-methyl-5-(trifluoromethyl)-3-pyrazolyl]-2-chloro-4-fluorobenzoate IUPAC Name: 5-[4-bromo-1-methyl-5-(trifluoromethyl)pyrazol-3-yl]-2-chloro-4-fluorobenzoate Traditional Name: 5-[4-bromo-1-methyl-5-(trifluoromethyl)pyrazol-3-yl]-2-chloro-4-fluoro-benzoate Formula: C12H5BrClF4N2O2- MolecularWeight: 400.530913

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=N1)C2=CC(=C(C=C2F)Cl)C(=O)[O-])Br)C(F)(F)F

Isomeric SMILES

CN1C(=C(C(=N1)C2=CC(=C(C=C2F)Cl)C(=O)[O-])Br)C(F)(F)F

InChI

InChI=1S/C12H6BrClF4N2O2/c1-20-10(12(16,17)18)8(13)9(19-20)5-2-4(11(21)22)6(14)3-7(5)15/h2-3H,1H3,(H,21,22)/p-1