2,7-bis[2-(4-ethynyl-2,5-dihexoxy-phenyl)ethynyl]fluoren-9-one

Systemtic Name: 2,7-bis[2-(4-ethynyl-2,5-dihexoxy-phenyl)ethynyl]fluoren-9-one Openeye Name: 2,7-bis[2-(4-ethynyl-2,5-dihexoxy-phenyl)ethynyl]fluoren-9-one CAS Name: 2,7-bis[2-(4-ethynyl-2,5-dihexoxyphenyl)ethynyl]-9-fluorenone IUPAC Name: 2,7-bis[2-(4-ethynyl-2,5-dihexoxyphenyl)ethynyl]fluoren-9-one Traditional Name: 2,7-bis[2-(4-ethynyl-2,5-dihexoxy-phenyl)ethynyl]fluoren-9-one Formula: C57H64O5 MolecularWeight: 829.11506

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC(=C(C=C1C#C)OCCCCCC)C#CC2=CC3=C(C=C2)C4=C(C3=O)C=C(C=C4)C#CC5=C(C=C(C(=C5)OCCCCCC)C#C)OCCCCCC

Isomeric SMILES

CCCCCCOC1=CC(=C(C=C1C#C)OCCCCCC)C#CC2=CC3=C(C=C2)C4=C(C3=O)C=C(C=C4)C#CC5=C(C=C(C(=C5)OCCCCCC)C#C)OCCCCCC

InChI

InChI=1S/C57H64O5/c1-7-13-17-21-33-59-53-41-47(55(39-45(53)11-5)61-35-23-19-15-9-3)29-25-43-27-31-49-50-32-28-44(38-52(50)57(58)51(49)37-43)26-30-48-42-54(60-34-22-18-14-8-2)46(12-6)40-56(48)62-36-24-20-16-10-4/h5-6,27-28,31-32,37-42H,7-10,13-24,33-36H2,1-4H3