5,12-bis(2,4-diphenylphenyl)-6,11-diphenyl-tetracene

Systemtic Name: 5,12-bis(2,4-diphenylphenyl)-6,11-diphenyl-tetracene Openeye Name: 5,12-bis(2,4-diphenylphenyl)-6,11-diphenyl-tetracene CAS Name: 5,12-bis(2,4-diphenylphenyl)-6,11-diphenyltetracene IUPAC Name: 5,12-bis(2,4-diphenylphenyl)-6,11-diphenyltetracene Traditional Name: 5,12-bis(2,4-diphenylphenyl)-6,11-diphenyl-tetracene Formula: C66H44 MolecularWeight: 837.05556

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=C(C=C2)C3=C4C=CC=CC4=C(C5=C(C6=CC=CC=C6C(=C35)C7=CC=CC=C7)C8=CC=CC=C8)C9=C(C=C(C=C9)C1=CC=CC=C1)C1=CC=CC=C1)C1=CC=CC=C1

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=C(C=C2)C3=C4C=CC=CC4=C(C5=C(C6=CC=CC=C6C(=C35)C7=CC=CC=C7)C8=CC=CC=C8)C9=C(C=C(C=C9)C1=CC=CC=C1)C1=CC=CC=C1)C1=CC=CC=C1

InChI

InChI=1S/C66H44/c1-7-23-45(24-8-1)51-39-41-57(59(43-51)47-27-11-3-12-28-47)63-55-37-21-22-38-56(55)64(58-42-40-52(46-25-9-2-10-26-46)44-60(58)48-29-13-4-14-30-48)66-62(50-33-17-6-18-34-50)54-36-20-19-35-53(54)61(65(63)66)49-31-15-5-16-32-49/h1-44H