2-[5-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)-2-fluoranyl-phenyl]pyridine-3-carbonitrile

Systemtic Name: 2-[5-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)-2-fluoranyl-phenyl]pyridine-3-carbonitrile Openeye Name: 2-[5-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)-2-fluoro-phenyl]pyridine-3-carbonitrile CAS Name: 2-[5-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)-2-fluorophenyl]-3-pyridinecarbonitrile IUPAC Name: 2-[5-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)-2-fluorophenyl]pyridine-3-carbonitrile Traditional Name: 2-[5-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)-2-fluoro-phenyl]nicotinonitrile Formula: C17H16BFN2O2 MolecularWeight: 310.130543

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Descriptors Computed from Structure

Canonical SMILES:

B1(OCC(CO1)(C)C)C2=CC(=C(C=C2)F)C3=C(C=CC=N3)C#N

Isomeric SMILES

B1(OCC(CO1)(C)C)C2=CC(=C(C=C2)F)C3=C(C=CC=N3)C#N

InChI

InChI=1S/C17H16BFN2O2/c1-17(2)10-22-18(23-11-17)13-5-6-15(19)14(8-13)16-12(9-20)4-3-7-21-16/h3-8H,10-11H2,1-2H3