2-fluoranyl-4-(5-pentyl-1,3-dioxan-2-yl)benzenecarbonitrile

Systemtic Name: 2-fluoranyl-4-(5-pentyl-1,3-dioxan-2-yl)benzenecarbonitrile Openeye Name: 2-fluoro-4-(5-pentyl-1,3-dioxan-2-yl)benzonitrile CAS Name: 2-fluoro-4-(5-pentyl-1,3-dioxan-2-yl)benzonitrile IUPAC Name: 2-fluoro-4-(5-pentyl-1,3-dioxan-2-yl)benzonitrile Traditional Name: 4-(5-amyl-1,3-dioxan-2-yl)-2-fluoro-benzonitrile Formula: C16H20FNO2 MolecularWeight: 277.333903

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1COC(OC1)C2=CC(=C(C=C2)C#N)F

Isomeric SMILES

CCCCCC1COC(OC1)C2=CC(=C(C=C2)C#N)F

InChI

InChI=1S/C16H20FNO2/c1-2-3-4-5-12-10-19-16(20-11-12)13-6-7-14(9-18)15(17)8-13/h6-8,12,16H,2-5,10-11H2,1H3