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

Systemtic Name: 3-fluoranyl-4-(5-heptyl-1,3-dioxan-2-yl)benzenecarbonitrile Openeye Name: 3-fluoro-4-(5-heptyl-1,3-dioxan-2-yl)benzonitrile CAS Name: 3-fluoro-4-(5-heptyl-1,3-dioxan-2-yl)benzonitrile IUPAC Name: 3-fluoro-4-(5-heptyl-1,3-dioxan-2-yl)benzonitrile Traditional Name: 3-fluoro-4-(5-heptyl-1,3-dioxan-2-yl)benzonitrile Formula: C18H24FNO2 MolecularWeight: 305.387063

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1COC(OC1)C2=C(C=C(C=C2)C#N)F

Isomeric SMILES

CCCCCCCC1COC(OC1)C2=C(C=C(C=C2)C#N)F

InChI

InChI=1S/C18H24FNO2/c1-2-3-4-5-6-7-15-12-21-18(22-13-15)16-9-8-14(11-20)10-17(16)19/h8-10,15,18H,2-7,12-13H2,1H3