4-[4-[2-(4-decylcyclohexyl)ethyl]phenyl]-2-fluoranyl-benzenecarbonitrile

Systemtic Name: 4-[4-[2-(4-decylcyclohexyl)ethyl]phenyl]-2-fluoranyl-benzenecarbonitrile Openeye Name: 4-[4-[2-(4-decylcyclohexyl)ethyl]phenyl]-2-fluoro-benzonitrile CAS Name: 4-[4-[2-(4-decylcyclohexyl)ethyl]phenyl]-2-fluorobenzonitrile IUPAC Name: 4-[4-[2-(4-decylcyclohexyl)ethyl]phenyl]-2-fluorobenzonitrile Traditional Name: 4-[4-[2-(4-decylcyclohexyl)ethyl]phenyl]-2-fluoro-benzonitrile Formula: C31H42FN MolecularWeight: 447.670283

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1CCC(CC1)CCC2=CC=C(C=C2)C3=CC(=C(C=C3)C#N)F

Isomeric SMILES

CCCCCCCCCCC1CCC(CC1)CCC2=CC=C(C=C2)C3=CC(=C(C=C3)C#N)F

InChI

InChI=1S/C31H42FN/c1-2-3-4-5-6-7-8-9-10-25-11-13-26(14-12-25)15-16-27-17-19-28(20-18-27)29-21-22-30(24-33)31(32)23-29/h17-23,25-26H,2-16H2,1H3