2-fluoranyl-4-[[4-(5-heptylpyrimidin-2-yl)phenyl]methoxy]benzenecarbonitrile

Systemtic Name: 2-fluoranyl-4-[[4-(5-heptylpyrimidin-2-yl)phenyl]methoxy]benzenecarbonitrile Openeye Name: 2-fluoro-4-[[4-(5-heptylpyrimidin-2-yl)phenyl]methoxy]benzonitrile CAS Name: 2-fluoro-4-[[4-(5-heptyl-2-pyrimidinyl)phenyl]methoxy]benzonitrile IUPAC Name: 2-fluoro-4-[[4-(5-heptylpyrimidin-2-yl)phenyl]methoxy]benzonitrile Traditional Name: 2-fluoro-4-[4-(5-heptylpyrimidin-2-yl)benzyl]oxy-benzonitrile Formula: C25H26FN3O MolecularWeight: 403.491843

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)COC3=CC(=C(C=C3)C#N)F

Isomeric SMILES

CCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)COC3=CC(=C(C=C3)C#N)F

InChI

InChI=1S/C25H26FN3O/c1-2-3-4-5-6-7-20-16-28-25(29-17-20)21-10-8-19(9-11-21)18-30-23-13-12-22(15-27)24(26)14-23/h8-14,16-17H,2-7,18H2,1H3