dimethyl 4-[4-bromanyl-5-(trifluoromethyl)-1H-imidazol-2-yl]-5-fluoranyl-benzene-1,2-dicarboxylate

Systemtic Name: dimethyl 4-[4-bromanyl-5-(trifluoromethyl)-1H-imidazol-2-yl]-5-fluoranyl-benzene-1,2-dicarboxylate Openeye Name: dimethyl 4-[4-bromo-5-(trifluoromethyl)-1H-imidazol-2-yl]-5-fluoro-benzene-1,2-dicarboxylate CAS Name: 4-[4-bromo-5-(trifluoromethyl)-1H-imidazol-2-yl]-5-fluorobenzene-1,2-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 4-[4-bromo-5-(trifluoromethyl)-1H-imidazol-2-yl]-5-fluorobenzene-1,2-dicarboxylate Traditional Name: 4-[4-bromo-5-(trifluoromethyl)-1H-imidazol-2-yl]-5-fluoro-benzene-1,2-dicarboxylic acid dimethyl ester Formula: C14H9BrF4N2O4 MolecularWeight: 425.129873

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C(C(=C1)C2=NC(=C(N2)C(F)(F)F)Br)F)C(=O)OC

Isomeric SMILES

COC(=O)C1=C(C=C(C(=C1)C2=NC(=C(N2)C(F)(F)F)Br)F)C(=O)OC

InChI

InChI=1S/C14H9BrF4N2O4/c1-24-12(22)5-3-7(8(16)4-6(5)13(23)25-2)11-20-9(10(15)21-11)14(17,18)19/h3-4H,1-2H3,(H,20,21)