2-fluoranyl-1-[2-(3-fluoranyl-4-heptyl-phenyl)ethynyl]-4-[2-(4-methylphenyl)ethynyl]benzene

Systemtic Name: 2-fluoranyl-1-[2-(3-fluoranyl-4-heptyl-phenyl)ethynyl]-4-[2-(4-methylphenyl)ethynyl]benzene Openeye Name: 2-fluoro-1-[2-(3-fluoro-4-heptyl-phenyl)ethynyl]-4-[2-(p-tolyl)ethynyl]benzene CAS Name: 2-fluoro-1-[2-(3-fluoro-4-heptylphenyl)ethynyl]-4-[2-(4-methylphenyl)ethynyl]benzene IUPAC Name: 2-fluoro-1-[2-(3-fluoro-4-heptylphenyl)ethynyl]-4-[2-(4-methylphenyl)ethynyl]benzene Traditional Name: 2-fluoro-1-[2-(3-fluoro-4-heptyl-phenyl)ethynyl]-4-[2-(p-tolyl)ethynyl]benzene Formula: C30H28F2 MolecularWeight: 426.540126

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H28F2/c1-3-4-5-6-7-8-27-18-15-26(22-29(27)31)17-20-28-19-16-25(21-30(28)32)14-13-24-11-9-23(2)10-12-24/h9-12,15-16,18-19,21-22H,3-8H2,1-2H3