7-chloranyl-5-fluoranyl-4-[1-methyl-2-oxidanylidene-6-(trifluoromethyl)pyridin-3-yl]-1-benzofuran-2-carboxylic acid

Systemtic Name: 7-chloranyl-5-fluoranyl-4-[1-methyl-2-oxidanylidene-6-(trifluoromethyl)pyridin-3-yl]-1-benzofuran-2-carboxylic acid Openeye Name: 7-chloro-5-fluoro-4-[1-methyl-2-oxo-6-(trifluoromethyl)-3-pyridyl]benzofuran-2-carboxylic acid CAS Name: 7-chloro-5-fluoro-4-[1-methyl-2-oxo-6-(trifluoromethyl)-3-pyridinyl]-2-benzofurancarboxylic acid IUPAC Name: 7-chloro-5-fluoro-4-[1-methyl-2-oxo-6-(trifluoromethyl)pyridin-3-yl]-1-benzofuran-2-carboxylic acid Traditional Name: 7-chloro-5-fluoro-4-[2-keto-1-methyl-6-(trifluoromethyl)-3-pyridyl]coumarilic acid Formula: C16H8ClF4NO4 MolecularWeight: 389.685633

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=C(C1=O)C2=C3C=C(OC3=C(C=C2F)Cl)C(=O)O)C(F)(F)F

Isomeric SMILES

CN1C(=CC=C(C1=O)C2=C3C=C(OC3=C(C=C2F)Cl)C(=O)O)C(F)(F)F

InChI

InChI=1S/C16H8ClF4NO4/c1-22-11(16(19,20)21)3-2-6(14(22)23)12-7-4-10(15(24)25)26-13(7)8(17)5-9(12)18/h2-5H,1H3,(H,24,25)