2-fluoranyl-4-[5-[2-(4-nonylcyclohexyl)ethyl]-1,3-dioxan-2-yl]benzenecarbonitrile

Systemtic Name: 2-fluoranyl-4-[5-[2-(4-nonylcyclohexyl)ethyl]-1,3-dioxan-2-yl]benzenecarbonitrile Openeye Name: 2-fluoro-4-[5-[2-(4-nonylcyclohexyl)ethyl]-1,3-dioxan-2-yl]benzonitrile CAS Name: 2-fluoro-4-[5-[2-(4-nonylcyclohexyl)ethyl]-1,3-dioxan-2-yl]benzonitrile IUPAC Name: 2-fluoro-4-[5-[2-(4-nonylcyclohexyl)ethyl]-1,3-dioxan-2-yl]benzonitrile Traditional Name: 2-fluoro-4-[5-[2-(4-nonylcyclohexyl)ethyl]-1,3-dioxan-2-yl]benzonitrile Formula: C28H42FNO2 MolecularWeight: 443.636983

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1CCC(CC1)CCC2COC(OC2)C3=CC(=C(C=C3)C#N)F

Isomeric SMILES

CCCCCCCCCC1CCC(CC1)CCC2COC(OC2)C3=CC(=C(C=C3)C#N)F

InChI

InChI=1S/C28H42FNO2/c1-2-3-4-5-6-7-8-9-22-10-12-23(13-11-22)14-15-24-20-31-28(32-21-24)25-16-17-26(19-30)27(29)18-25/h16-18,22-24,28H,2-15,20-21H2,1H3