4-[2-[4-(4-but-2-ynylcyclohexyl)phenyl]ethynyl]-2-fluoranyl-1-pentyl-benzene

Systemtic Name: 4-[2-[4-(4-but-2-ynylcyclohexyl)phenyl]ethynyl]-2-fluoranyl-1-pentyl-benzene Openeye Name: 4-[2-[4-(4-but-2-ynylcyclohexyl)phenyl]ethynyl]-2-fluoro-1-pentyl-benzene CAS Name: 4-[2-[4-(4-but-2-ynylcyclohexyl)phenyl]ethynyl]-2-fluoro-1-pentylbenzene IUPAC Name: 4-[2-[4-(4-but-2-ynylcyclohexyl)phenyl]ethynyl]-2-fluoro-1-pentylbenzene Traditional Name: 1-amyl-4-[2-[4-(4-but-2-ynylcyclohexyl)phenyl]ethynyl]-2-fluoro-benzene Formula: C29H33F MolecularWeight: 400.570723

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C=C(C=C1)C#CC2=CC=C(C=C2)C3CCC(CC3)CC#CC)F

Isomeric SMILES

CCCCCC1=C(C=C(C=C1)C#CC2=CC=C(C=C2)C3CCC(CC3)CC#CC)F

InChI

InChI=1S/C29H33F/c1-3-5-7-9-28-21-16-25(22-29(28)30)11-10-24-14-19-27(20-15-24)26-17-12-23(13-18-26)8-6-4-2/h14-16,19-23,26H,3,5,7-9,12-13,17-18H2,1-2H3