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

Systemtic Name: 1-[2-[4-[2-(4-ethylphenyl)ethynyl]phenyl]ethynyl]-2-fluoranyl-4-hexyl-benzene Openeye Name: 1-[2-[4-[2-(4-ethylphenyl)ethynyl]phenyl]ethynyl]-2-fluoro-4-hexyl-benzene CAS Name: 1-[2-[4-[2-(4-ethylphenyl)ethynyl]phenyl]ethynyl]-2-fluoro-4-hexylbenzene IUPAC Name: 1-[2-[4-[2-(4-ethylphenyl)ethynyl]phenyl]ethynyl]-2-fluoro-4-hexylbenzene Traditional Name: 1-[2-[4-[2-(4-ethylphenyl)ethynyl]phenyl]ethynyl]-2-fluoro-4-hexyl-benzene Formula: C30H29F MolecularWeight: 408.549663

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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)CC)F

Isomeric SMILES

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

InChI

InChI=1S/C30H29F/c1-3-5-6-7-8-28-20-22-29(30(31)23-28)21-19-27-17-15-26(16-18-27)14-13-25-11-9-24(4-2)10-12-25/h9-12,15-18,20,22-23H,3-8H2,1-2H3