2,7-bis[5-phenyl-2-[4-(2-phenylethynyl)phenyl]-1H-imidazol-4-yl]fluoren-9-one

Systemtic Name: 2,7-bis[5-phenyl-2-[4-(2-phenylethynyl)phenyl]-1H-imidazol-4-yl]fluoren-9-one Openeye Name: 2,7-bis[5-phenyl-2-[4-(2-phenylethynyl)phenyl]-1H-imidazol-4-yl]fluoren-9-one CAS Name: 2,7-bis[5-phenyl-2-[4-(2-phenylethynyl)phenyl]-1H-imidazol-4-yl]-9-fluorenone IUPAC Name: 2,7-bis[5-phenyl-2-[4-(2-phenylethynyl)phenyl]-1H-imidazol-4-yl]fluoren-9-one Traditional Name: 2,7-bis[5-phenyl-2-[4-(2-phenylethynyl)phenyl]-1H-imidazol-4-yl]fluoren-9-one Formula: C59H36N4O MolecularWeight: 816.94334

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CC2=CC=C(C=C2)C3=NC(=C(N3)C4=CC=CC=C4)C5=CC6=C(C=C5)C7=C(C6=O)C=C(C=C7)C8=C(NC(=N8)C9=CC=C(C=C9)C#CC1=CC=CC=C1)C1=CC=CC=C1

Isomeric SMILES

C1=CC=C(C=C1)C#CC2=CC=C(C=C2)C3=NC(=C(N3)C4=CC=CC=C4)C5=CC6=C(C=C5)C7=C(C6=O)C=C(C=C7)C8=C(NC(=N8)C9=CC=C(C=C9)C#CC1=CC=CC=C1)C1=CC=CC=C1

InChI

InChI=1S/C59H36N4O/c64-57-51-37-47(55-53(43-17-9-3-10-18-43)60-58(62-55)45-29-25-41(26-30-45)23-21-39-13-5-1-6-14-39)33-35-49(51)50-36-34-48(38-52(50)57)56-54(44-19-11-4-12-20-44)61-59(63-56)46-31-27-42(28-32-46)24-22-40-15-7-2-8-16-40/h1-20,25-38H,(H,60,62)(H,61,63)