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

Systemtic Name: 2-fluoranyl-4-[2-[4-[2-(4-heptylphenyl)ethynyl]phenyl]ethynyl]-1-hexyl-benzene Openeye Name: 2-fluoro-4-[2-[4-[2-(4-heptylphenyl)ethynyl]phenyl]ethynyl]-1-hexyl-benzene CAS Name: 2-fluoro-4-[2-[4-[2-(4-heptylphenyl)ethynyl]phenyl]ethynyl]-1-hexylbenzene IUPAC Name: 2-fluoro-4-[2-[4-[2-(4-heptylphenyl)ethynyl]phenyl]ethynyl]-1-hexylbenzene Traditional Name: 2-fluoro-4-[2-[4-[2-(4-heptylphenyl)ethynyl]phenyl]ethynyl]-1-hexyl-benzene Formula: C35H39F MolecularWeight: 478.682563

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C#CC2=CC=C(C=C2)C#CC3=CC(=C(C=C3)CCCCCC)F

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C#CC2=CC=C(C=C2)C#CC3=CC(=C(C=C3)CCCCCC)F

InChI

InChI=1S/C35H39F/c1-3-5-7-9-10-12-29-14-16-30(17-15-29)18-19-31-20-22-32(23-21-31)24-25-33-26-27-34(35(36)28-33)13-11-8-6-4-2/h14-17,20-23,26-28H,3-13H2,1-2H3