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

Systemtic Name: 2-fluoranyl-4-[[4-(5-nonylpyrimidin-2-yl)phenyl]methoxy]benzenecarbonitrile Openeye Name: 2-fluoro-4-[[4-(5-nonylpyrimidin-2-yl)phenyl]methoxy]benzonitrile CAS Name: 2-fluoro-4-[[4-(5-nonyl-2-pyrimidinyl)phenyl]methoxy]benzonitrile IUPAC Name: 2-fluoro-4-[[4-(5-nonylpyrimidin-2-yl)phenyl]methoxy]benzonitrile Traditional Name: 2-fluoro-4-[4-(5-nonylpyrimidin-2-yl)benzyl]oxy-benzonitrile Formula: C27H30FN3O MolecularWeight: 431.545003

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)COC3=CC(=C(C=C3)C#N)F

Isomeric SMILES

CCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)COC3=CC(=C(C=C3)C#N)F

InChI

InChI=1S/C27H30FN3O/c1-2-3-4-5-6-7-8-9-22-18-30-27(31-19-22)23-12-10-21(11-13-23)20-32-25-15-14-24(17-29)26(28)16-25/h10-16,18-19H,2-9,20H2,1H3