4-[[4-(5-butoxypyrimidin-2-yl)phenyl]methoxy]-2,3-bis(fluoranyl)benzenecarbonitrile

Systemtic Name: 4-[[4-(5-butoxypyrimidin-2-yl)phenyl]methoxy]-2,3-bis(fluoranyl)benzenecarbonitrile Openeye Name: 4-[[4-(5-butoxypyrimidin-2-yl)phenyl]methoxy]-2,3-difluoro-benzonitrile CAS Name: 4-[[4-(5-butoxy-2-pyrimidinyl)phenyl]methoxy]-2,3-difluorobenzonitrile IUPAC Name: 4-[[4-(5-butoxypyrimidin-2-yl)phenyl]methoxy]-2,3-difluorobenzonitrile Traditional Name: 4-[4-(5-butoxypyrimidin-2-yl)benzyl]oxy-2,3-difluoro-benzonitrile Formula: C22H19F2N3O2 MolecularWeight: 395.401966

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)COC3=C(C(=C(C=C3)C#N)F)F

Isomeric SMILES

CCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)COC3=C(C(=C(C=C3)C#N)F)F

InChI

InChI=1S/C22H19F2N3O2/c1-2-3-10-28-18-12-26-22(27-13-18)16-6-4-15(5-7-16)14-29-19-9-8-17(11-25)20(23)21(19)24/h4-9,12-13H,2-3,10,14H2,1H3