6-[2,2-bis(fluoranyl)-2-pyridin-2-yl-ethoxy]-2-methyl-1-oxidanylidene-4-phenyl-isoquinoline-3-carbonitrile

Systemtic Name: 6-[2,2-bis(fluoranyl)-2-pyridin-2-yl-ethoxy]-2-methyl-1-oxidanylidene-4-phenyl-isoquinoline-3-carbonitrile Openeye Name: 6-[2,2-difluoro-2-(2-pyridyl)ethoxy]-2-methyl-1-oxo-4-phenyl-isoquinoline-3-carbonitrile CAS Name: 6-[2,2-difluoro-2-(2-pyridinyl)ethoxy]-2-methyl-1-oxo-4-phenyl-3-isoquinolinecarbonitrile IUPAC Name: 6-(2,2-difluoro-2-pyridin-2-ylethoxy)-2-methyl-1-oxo-4-phenylisoquinoline-3-carbonitrile Traditional Name: 6-[2,2-difluoro-2-(2-pyridyl)ethoxy]-1-keto-2-methyl-4-phenyl-isoquinoline-3-carbonitrile Formula: C24H17F2N3O2 MolecularWeight: 417.407486

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C2=C(C1=O)C=CC(=C2)OCC(C3=CC=CC=N3)(F)F)C4=CC=CC=C4)C#N

Isomeric SMILES

CN1C(=C(C2=C(C1=O)C=CC(=C2)OCC(C3=CC=CC=N3)(F)F)C4=CC=CC=C4)C#N

InChI

InChI=1S/C24H17F2N3O2/c1-29-20(14-27)22(16-7-3-2-4-8-16)19-13-17(10-11-18(19)23(29)30)31-15-24(25,26)21-9-5-6-12-28-21/h2-13H,15H2,1H3