1-[2-[4-[2-(4-butylphenyl)ethynyl]phenyl]ethynyl]-2,3-bis(fluoranyl)-4-propyl-benzene

Systemtic Name: 1-[2-[4-[2-(4-butylphenyl)ethynyl]phenyl]ethynyl]-2,3-bis(fluoranyl)-4-propyl-benzene Openeye Name: 1-[2-[4-[2-(4-butylphenyl)ethynyl]phenyl]ethynyl]-2,3-difluoro-4-propyl-benzene CAS Name: 1-[2-[4-[2-(4-butylphenyl)ethynyl]phenyl]ethynyl]-2,3-difluoro-4-propylbenzene IUPAC Name: 1-[2-[4-[2-(4-butylphenyl)ethynyl]phenyl]ethynyl]-2,3-difluoro-4-propylbenzene Traditional Name: 1-[2-[4-[2-(4-butylphenyl)ethynyl]phenyl]ethynyl]-2,3-difluoro-4-propyl-benzene Formula: C29H26F2 MolecularWeight: 412.513546

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C#CC2=CC=C(C=C2)C#CC3=C(C(=C(C=C3)CCC)F)F

Isomeric SMILES

CCCCC1=CC=C(C=C1)C#CC2=CC=C(C=C2)C#CC3=C(C(=C(C=C3)CCC)F)F

InChI

InChI=1S/C29H26F2/c1-3-5-7-22-8-10-23(11-9-22)12-13-24-14-16-25(17-15-24)18-19-27-21-20-26(6-4-2)28(30)29(27)31/h8-11,14-17,20-21H,3-7H2,1-2H3