9,10-bis[2-(4-dodecylphenyl)ethynyl]anthracene

Systemtic Name: 9,10-bis[2-(4-dodecylphenyl)ethynyl]anthracene Openeye Name: 9,10-bis[2-(4-dodecylphenyl)ethynyl]anthracene CAS Name: 9,10-bis[2-(4-dodecylphenyl)ethynyl]anthracene IUPAC Name: 9,10-bis[2-(4-dodecylphenyl)ethynyl]anthracene Traditional Name: 9,10-bis[2-(4-laurylphenyl)ethynyl]anthracene Formula: C54H66 MolecularWeight: 715.10184

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=C(C=C1)C#CC2=C3C=CC=CC3=C(C4=CC=CC=C42)C#CC5=CC=C(C=C5)CCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(C=C1)C#CC2=C3C=CC=CC3=C(C4=CC=CC=C42)C#CC5=CC=C(C=C5)CCCCCCCCCCCC

InChI

InChI=1S/C54H66/c1-3-5-7-9-11-13-15-17-19-21-27-45-33-37-47(38-34-45)41-43-53-49-29-23-25-31-51(49)54(52-32-26-24-30-50(52)53)44-42-48-39-35-46(36-40-48)28-22-20-18-16-14-12-10-8-6-4-2/h23-26,29-40H,3-22,27-28H2,1-2H3