1,2,3,4,5-pentakis(4-tert-butylphenyl)-6-(4-iodophenyl)benzene

Systemtic Name: 1,2,3,4,5-pentakis(4-tert-butylphenyl)-6-(4-iodophenyl)benzene Openeye Name: 1,2,3,4,5-pentakis(4-tert-butylphenyl)-6-(4-iodophenyl)benzene CAS Name: 1,2,3,4,5-pentakis(4-tert-butylphenyl)-6-(4-iodophenyl)benzene IUPAC Name: 1,2,3,4,5-pentakis(4-tert-butylphenyl)-6-(4-iodophenyl)benzene Traditional Name: 1,2,3,4,5-pentakis(4-tert-butylphenyl)-6-(4-iodophenyl)benzene Formula: C62H69I MolecularWeight: 941.11573

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=C(C(=C(C(=C2C3=CC=C(C=C3)C(C)(C)C)C4=CC=C(C=C4)C(C)(C)C)C5=CC=C(C=C5)I)C6=CC=C(C=C6)C(C)(C)C)C7=CC=C(C=C7)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=C(C(=C(C(=C2C3=CC=C(C=C3)C(C)(C)C)C4=CC=C(C=C4)C(C)(C)C)C5=CC=C(C=C5)I)C6=CC=C(C=C6)C(C)(C)C)C7=CC=C(C=C7)C(C)(C)C

InChI

InChI=1S/C62H69I/c1-58(2,3)46-28-16-40(17-29-46)52-53(41-18-30-47(31-19-41)59(4,5)6)55(43-22-34-49(35-23-43)61(10,11)12)57(45-26-38-51(63)39-27-45)56(44-24-36-50(37-25-44)62(13,14)15)54(52)42-20-32-48(33-21-42)60(7,8)9/h16-39H,1-15H3