3-fluoranyl-4-[2-(4-hexylcyclohexyl)ethyl]benzenecarbonitrile

Systemtic Name: 3-fluoranyl-4-[2-(4-hexylcyclohexyl)ethyl]benzenecarbonitrile Openeye Name: 3-fluoro-4-[2-(4-hexylcyclohexyl)ethyl]benzonitrile CAS Name: 3-fluoro-4-[2-(4-hexylcyclohexyl)ethyl]benzonitrile IUPAC Name: 3-fluoro-4-[2-(4-hexylcyclohexyl)ethyl]benzonitrile Traditional Name: 3-fluoro-4-[2-(4-hexylcyclohexyl)ethyl]benzonitrile Formula: C21H30FN MolecularWeight: 315.468003

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CCC(CC1)CCC2=C(C=C(C=C2)C#N)F

Isomeric SMILES

CCCCCCC1CCC(CC1)CCC2=C(C=C(C=C2)C#N)F

InChI

InChI=1S/C21H30FN/c1-2-3-4-5-6-17-7-9-18(10-8-17)11-13-20-14-12-19(16-23)15-21(20)22/h12,14-15,17-18H,2-11,13H2,1H3