4-butyl-1-[4-[2-(4-butylcyclohexen-1-yl)ethynyl]phenyl]-2-fluoranyl-benzene

Systemtic Name: 4-butyl-1-[4-[2-(4-butylcyclohexen-1-yl)ethynyl]phenyl]-2-fluoranyl-benzene Openeye Name: 4-butyl-1-[4-[2-(4-butylcyclohexen-1-yl)ethynyl]phenyl]-2-fluoro-benzene CAS Name: 4-butyl-1-[4-[2-(4-butyl-1-cyclohexenyl)ethynyl]phenyl]-2-fluorobenzene IUPAC Name: 4-butyl-1-[4-[2-(4-butylcyclohexen-1-yl)ethynyl]phenyl]-2-fluorobenzene Traditional Name: 4-butyl-1-[4-[2-(4-butylcyclohexen-1-yl)ethynyl]phenyl]-2-fluoro-benzene Formula: C28H33F MolecularWeight: 388.560023

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(=CC1)C#CC2=CC=C(C=C2)C3=C(C=C(C=C3)CCCC)F

Isomeric SMILES

CCCCC1CCC(=CC1)C#CC2=CC=C(C=C2)C3=C(C=C(C=C3)CCCC)F

InChI

InChI=1S/C28H33F/c1-3-5-7-22-9-11-23(12-10-22)13-14-24-15-18-26(19-16-24)27-20-17-25(8-6-4-2)21-28(27)29/h11,15-22H,3-10,12H2,1-2H3