5-[4-bromanyl-1-methyl-5-(trifluoromethyl)pyrazol-3-yl]-2-chloranyl-4-fluoranyl-cyclohexa-1,4-diene-1-carboxylic acid

Systemtic Name: 5-[4-bromanyl-1-methyl-5-(trifluoromethyl)pyrazol-3-yl]-2-chloranyl-4-fluoranyl-cyclohexa-1,4-diene-1-carboxylic acid Openeye Name: 5-[4-bromo-1-methyl-5-(trifluoromethyl)pyrazol-3-yl]-2-chloro-4-fluoro-cyclohexa-1,4-diene-1-carboxylic acid CAS Name: 5-[4-bromo-1-methyl-5-(trifluoromethyl)-3-pyrazolyl]-2-chloro-4-fluoro-1-cyclohexa-1,4-dienecarboxylic acid IUPAC Name: 5-[4-bromo-1-methyl-5-(trifluoromethyl)pyrazol-3-yl]-2-chloro-4-fluorocyclohexa-1,4-diene-1-carboxylic acid Traditional Name: 5-[4-bromo-1-methyl-5-(trifluoromethyl)pyrazol-3-yl]-2-chloro-4-fluoro-cyclohexa-1,4-diene-1-carboxylic acid Formula: C12H8BrClF4N2O2 MolecularWeight: 403.554733

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=N1)C2=C(CC(=C(C2)C(=O)O)Cl)F)Br)C(F)(F)F

Isomeric SMILES

CN1C(=C(C(=N1)C2=C(CC(=C(C2)C(=O)O)Cl)F)Br)C(F)(F)F

InChI

InChI=1S/C12H8BrClF4N2O2/c1-20-10(12(16,17)18)8(13)9(19-20)5-2-4(11(21)22)6(14)3-7(5)15/h2-3H2,1H3,(H,21,22)