1-butyl-2-fluoranyl-4-[2-[2-fluoranyl-4-[2-(4-pentylphenyl)ethynyl]phenyl]ethynyl]benzene

Systemtic Name: 1-butyl-2-fluoranyl-4-[2-[2-fluoranyl-4-[2-(4-pentylphenyl)ethynyl]phenyl]ethynyl]benzene Openeye Name: 1-butyl-2-fluoro-4-[2-[2-fluoro-4-[2-(4-pentylphenyl)ethynyl]phenyl]ethynyl]benzene CAS Name: 1-butyl-2-fluoro-4-[2-[2-fluoro-4-[2-(4-pentylphenyl)ethynyl]phenyl]ethynyl]benzene IUPAC Name: 1-butyl-2-fluoro-4-[2-[2-fluoro-4-[2-(4-pentylphenyl)ethynyl]phenyl]ethynyl]benzene Traditional Name: 4-[2-(4-amylphenyl)ethynyl]-1-[2-(4-butyl-3-fluoro-phenyl)ethynyl]-2-fluoro-benzene Formula: C31H30F2 MolecularWeight: 440.566706

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C#CC2=CC(=C(C=C2)C#CC3=CC(=C(C=C3)CCCC)F)F

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C#CC2=CC(=C(C=C2)C#CC3=CC(=C(C=C3)CCCC)F)F

InChI

InChI=1S/C31H30F2/c1-3-5-7-8-24-10-12-25(13-11-24)14-15-26-17-20-29(31(33)22-26)21-18-27-16-19-28(9-6-4-2)30(32)23-27/h10-13,16-17,19-20,22-23H,3-9H2,1-2H3