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

Systemtic Name: 2-fluoranyl-1-heptyl-4-[2-[4-[2-(4-heptylphenyl)ethynyl]phenyl]ethynyl]benzene Openeye Name: 2-fluoro-1-heptyl-4-[2-[4-[2-(4-heptylphenyl)ethynyl]phenyl]ethynyl]benzene CAS Name: 2-fluoro-1-heptyl-4-[2-[4-[2-(4-heptylphenyl)ethynyl]phenyl]ethynyl]benzene IUPAC Name: 2-fluoro-1-heptyl-4-[2-[4-[2-(4-heptylphenyl)ethynyl]phenyl]ethynyl]benzene Traditional Name: 2-fluoro-1-heptyl-4-[2-[4-[2-(4-heptylphenyl)ethynyl]phenyl]ethynyl]benzene Formula: C36H41F MolecularWeight: 492.709143

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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)CCCCCCC)F

Isomeric SMILES

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

InChI

InChI=1S/C36H41F/c1-3-5-7-9-11-13-30-15-17-31(18-16-30)19-20-32-21-23-33(24-22-32)25-26-34-27-28-35(36(37)29-34)14-12-10-8-6-4-2/h15-18,21-24,27-29H,3-14H2,1-2H3