6,15-bis(4-tert-butylphenyl)-8,17-diphenyl-7,16-dihydroheptacene

Systemtic Name: 6,15-bis(4-tert-butylphenyl)-8,17-diphenyl-7,16-dihydroheptacene Openeye Name: 6,15-bis(4-tert-butylphenyl)-8,17-diphenyl-7,16-dihydroheptacene CAS Name: 6,15-bis(4-tert-butylphenyl)-8,17-diphenyl-7,16-dihydroheptacene IUPAC Name: 6,15-bis(4-tert-butylphenyl)-8,17-diphenyl-7,16-dihydroheptacene Traditional Name: 6,15-bis(4-tert-butylphenyl)-8,17-diphenyl-7,16-dihydroheptacene Formula: C62H52 MolecularWeight: 797.07628

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=C3CC4=C(C5=CC6=CC=CC=C6C=C5C(=C4CC3=C(C7=CC8=CC=CC=C8C=C72)C9=CC=CC=C9)C1=CC=C(C=C1)C(C)(C)C)C1=CC=CC=C1

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=C3CC4=C(C5=CC6=CC=CC=C6C=C5C(=C4CC3=C(C7=CC8=CC=CC=C8C=C72)C9=CC=CC=C9)C1=CC=C(C=C1)C(C)(C)C)C1=CC=CC=C1

InChI

InChI=1S/C62H52/c1-61(2,3)47-29-25-41(26-30-47)59-51-35-45-23-15-13-21-43(45)33-49(51)57(39-17-9-7-10-18-39)53-38-56-54(37-55(53)59)58(40-19-11-8-12-20-40)50-34-44-22-14-16-24-46(44)36-52(50)60(56)42-27-31-48(32-28-42)62(4,5)6/h7-36H,37-38H2,1-6H3