1-[2-[4-[2-(4-butylphenyl)ethynyl]phenyl]ethynyl]-2-fluoranyl-4-hexyl-benzene

Systemtic Name: 1-[2-[4-[2-(4-butylphenyl)ethynyl]phenyl]ethynyl]-2-fluoranyl-4-hexyl-benzene Openeye Name: 1-[2-[4-[2-(4-butylphenyl)ethynyl]phenyl]ethynyl]-2-fluoro-4-hexyl-benzene CAS Name: 1-[2-[4-[2-(4-butylphenyl)ethynyl]phenyl]ethynyl]-2-fluoro-4-hexylbenzene IUPAC Name: 1-[2-[4-[2-(4-butylphenyl)ethynyl]phenyl]ethynyl]-2-fluoro-4-hexylbenzene Traditional Name: 1-[2-[4-[2-(4-butylphenyl)ethynyl]phenyl]ethynyl]-2-fluoro-4-hexyl-benzene Formula: C32H33F MolecularWeight: 436.602823

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC(=C(C=C1)C#CC2=CC=C(C=C2)C#CC3=CC=C(C=C3)CCCC)F

Isomeric SMILES

CCCCCCC1=CC(=C(C=C1)C#CC2=CC=C(C=C2)C#CC3=CC=C(C=C3)CCCC)F

InChI

InChI=1S/C32H33F/c1-3-5-7-8-10-30-22-24-31(32(33)25-30)23-21-29-19-17-28(18-20-29)16-15-27-13-11-26(12-14-27)9-6-4-2/h11-14,17-20,22,24-25H,3-10H2,1-2H3