1-[(1R,2S,4R,5R)-2-bromanyl-5-(6-chloranylpyridin-3-yl)-7-azabicyclo[2.2.1]heptan-7-yl]-2,2,2-tris(fluoranyl)ethanone

Systemtic Name: 1-[(1R,2S,4R,5R)-2-bromanyl-5-(6-chloranylpyridin-3-yl)-7-azabicyclo[2.2.1]heptan-7-yl]-2,2,2-tris(fluoranyl)ethanone Openeye Name: 1-[(1R,2S,4R,5R)-2-bromo-5-(6-chloro-3-pyridyl)-7-azabicyclo[2.2.1]heptan-7-yl]-2,2,2-trifluoro-ethanone CAS Name: 1-[(1R,2S,4R,5R)-2-bromo-5-(6-chloro-3-pyridinyl)-7-azabicyclo[2.2.1]heptan-7-yl]-2,2,2-trifluoroethanone IUPAC Name: 1-[(1R,2S,4R,5R)-2-bromo-5-(6-chloropyridin-3-yl)-7-azabicyclo[2.2.1]heptan-7-yl]-2,2,2-trifluoroethanone Traditional Name: 1-[(1R,2S,4R,5R)-2-bromo-5-(6-chloro-3-pyridyl)-7-azabicyclo[2.2.1]heptan-7-yl]-2,2,2-trifluoro-ethanone Formula: C13H11BrClF3N2O MolecularWeight: 383.59145

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C2CC(C1N2C(=O)C(F)(F)F)Br)C3=CN=C(C=C3)Cl

Isomeric SMILES

C1[C@@H]([C@H]2C[C@@H]([C@@H]1N2C(=O)C(F)(F)F)Br)C3=CN=C(C=C3)Cl

InChI

InChI=1S/C13H11BrClF3N2O/c14-8-4-9-7(6-1-2-11(15)19-5-6)3-10(8)20(9)12(21)13(16,17)18/h1-2,5,7-10H,3-4H2/t7-,8+,9-,10-/m1/s1