4-[2-(4-but-2-ynylphenyl)ethynyl]-2-fluoranyl-1-(4-pentylcyclohexyl)benzene

Systemtic Name: 4-[2-(4-but-2-ynylphenyl)ethynyl]-2-fluoranyl-1-(4-pentylcyclohexyl)benzene Openeye Name: 4-[2-(4-but-2-ynylphenyl)ethynyl]-2-fluoro-1-(4-pentylcyclohexyl)benzene CAS Name: 4-[2-(4-but-2-ynylphenyl)ethynyl]-2-fluoro-1-(4-pentylcyclohexyl)benzene IUPAC Name: 4-[2-(4-but-2-ynylphenyl)ethynyl]-2-fluoro-1-(4-pentylcyclohexyl)benzene Traditional Name: 1-(4-amylcyclohexyl)-4-[2-(4-but-2-ynylphenyl)ethynyl]-2-fluoro-benzene Formula: C29H33F MolecularWeight: 400.570723

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)C2=C(C=C(C=C2)C#CC3=CC=C(C=C3)CC#CC)F

Isomeric SMILES

CCCCCC1CCC(CC1)C2=C(C=C(C=C2)C#CC3=CC=C(C=C3)CC#CC)F

InChI

InChI=1S/C29H33F/c1-3-5-7-9-24-16-19-27(20-17-24)28-21-18-26(22-29(28)30)15-14-25-12-10-23(11-13-25)8-6-4-2/h10-13,18,21-22,24,27H,3,5,7-9,16-17,19-20H2,1-2H3