3-[[3-bromanyl-5-fluoranyl-2-oxidanylidene-6-(2-pyridin-4-ylethyl)-1H-pyridin-4-yl]oxy]-5-chloranyl-benzenecarbonitrile

Systemtic Name: 3-[[3-bromanyl-5-fluoranyl-2-oxidanylidene-6-(2-pyridin-4-ylethyl)-1H-pyridin-4-yl]oxy]-5-chloranyl-benzenecarbonitrile Openeye Name: 3-[[3-bromo-5-fluoro-2-oxo-6-[2-(4-pyridyl)ethyl]-1H-pyridin-4-yl]oxy]-5-chloro-benzonitrile CAS Name: 3-[[3-bromo-5-fluoro-2-oxo-6-(2-pyridin-4-ylethyl)-1H-pyridin-4-yl]oxy]-5-chlorobenzonitrile IUPAC Name: 3-[[3-bromo-5-fluoro-2-oxo-6-(2-pyridin-4-ylethyl)-1H-pyridin-4-yl]oxy]-5-chlorobenzonitrile Traditional Name: 3-[[3-bromo-5-fluoro-2-keto-6-[2-(4-pyridyl)ethyl]-1H-pyridin-4-yl]oxy]-5-chloro-benzonitrile Formula: C19H12BrClFN3O2 MolecularWeight: 448.672883

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CC=C1CCC2=C(C(=C(C(=O)N2)Br)OC3=CC(=CC(=C3)C#N)Cl)F

Isomeric SMILES

C1=CN=CC=C1CCC2=C(C(=C(C(=O)N2)Br)OC3=CC(=CC(=C3)C#N)Cl)F

InChI

InChI=1S/C19H12BrClFN3O2/c20-16-18(27-14-8-12(10-23)7-13(21)9-14)17(22)15(25-19(16)26)2-1-11-3-5-24-6-4-11/h3-9H,1-2H2,(H,25,26)