6-[6-[4-bromanyl-6-(trifluoromethyl)-1H-benzimidazol-2-yl]pyridin-3-yl]-5-chloranyl-pyridine-3-carboxylic acid

Systemtic Name: 6-[6-[4-bromanyl-6-(trifluoromethyl)-1H-benzimidazol-2-yl]pyridin-3-yl]-5-chloranyl-pyridine-3-carboxylic acid Openeye Name: 6-[6-[4-bromo-6-(trifluoromethyl)-1H-benzimidazol-2-yl]-3-pyridyl]-5-chloro-pyridine-3-carboxylic acid CAS Name: 6-[6-[4-bromo-6-(trifluoromethyl)-1H-benzimidazol-2-yl]-3-pyridinyl]-5-chloro-3-pyridinecarboxylic acid IUPAC Name: 6-[6-[4-bromo-6-(trifluoromethyl)-1H-benzimidazol-2-yl]pyridin-3-yl]-5-chloropyridine-3-carboxylic acid Traditional Name: 6-[6-[4-bromo-6-(trifluoromethyl)-1H-benzimidazol-2-yl]-3-pyridyl]-5-chloro-nicotinic acid Formula: C19H9BrClF3N4O2 MolecularWeight: 497.65257

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC=C1C2=C(C=C(C=N2)C(=O)O)Cl)C3=NC4=C(N3)C=C(C=C4Br)C(F)(F)F

Isomeric SMILES

C1=CC(=NC=C1C2=C(C=C(C=N2)C(=O)O)Cl)C3=NC4=C(N3)C=C(C=C4Br)C(F)(F)F

InChI

InChI=1S/C19H9BrClF3N4O2/c20-11-4-10(19(22,23)24)5-14-16(11)28-17(27-14)13-2-1-8(6-25-13)15-12(21)3-9(7-26-15)18(29)30/h1-7H,(H,27,28)(H,29,30)