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

Systemtic Name: 5,11-bis(4-dodecylphenyl)-6,12-diphenyl-tetracene Openeye Name: 5,11-bis(4-dodecylphenyl)-6,12-diphenyl-tetracene CAS Name: 5,11-bis(4-dodecylphenyl)-6,12-diphenyltetracene IUPAC Name: 5,11-bis(4-dodecylphenyl)-6,12-diphenyltetracene Traditional Name: 5,11-bis(4-laurylphenyl)-6,12-diphenyl-tetracene Formula: C66H76 MolecularWeight: 869.30964

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=C(C=C1)C2=C3C=CC=CC3=C(C4=C(C5=CC=CC=C5C(=C24)C6=CC=CC=C6)C7=CC=C(C=C7)CCCCCCCCCCCC)C8=CC=CC=C8

Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(C=C1)C2=C3C=CC=CC3=C(C4=C(C5=CC=CC=C5C(=C24)C6=CC=CC=C6)C7=CC=C(C=C7)CCCCCCCCCCCC)C8=CC=CC=C8

InChI

InChI=1S/C66H76/c1-3-5-7-9-11-13-15-17-19-23-33-51-43-47-55(48-44-51)63-59-41-31-29-39-57(59)62(54-37-27-22-28-38-54)66-64(60-42-32-30-40-58(60)61(65(63)66)53-35-25-21-26-36-53)56-49-45-52(46-50-56)34-24-20-18-16-14-12-10-8-6-4-2/h21-22,25-32,35-50H,3-20,23-24,33-34H2,1-2H3