3,10-ditert-butyl-5,12-bis(4-tert-butylphenyl)-6,13-diphenyl-naphtho[1,2-b]phenanthrene

Systemtic Name: 3,10-ditert-butyl-5,12-bis(4-tert-butylphenyl)-6,13-diphenyl-naphtho[1,2-b]phenanthrene Openeye Name: 3,10-ditert-butyl-5,12-bis(4-tert-butylphenyl)-6,13-diphenyl-naphtho[1,2-b]phenanthrene CAS Name: 3,10-ditert-butyl-5,12-bis(4-tert-butylphenyl)-6,13-diphenylnaphtho[1,2-b]phenanthrene IUPAC Name: 3,10-ditert-butyl-5,12-bis(4-tert-butylphenyl)-6,13-diphenylnaphtho[1,2-b]phenanthrene Traditional Name: 3,10-ditert-butyl-5,12-bis(4-tert-butylphenyl)-6,13-diphenyl-naphtho[1,2-b]phenanthrene Formula: C62H62 MolecularWeight: 807.15568

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=C(C3=CC4=C5C=CC(=CC5=C(C(=C4C=C3C6=C2C=C(C=C6)C(C)(C)C)C7=CC=CC=C7)C8=CC=C(C=C8)C(C)(C)C)C(C)(C)C)C9=CC=CC=C9

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=C(C3=CC4=C5C=CC(=CC5=C(C(=C4C=C3C6=C2C=C(C=C6)C(C)(C)C)C7=CC=CC=C7)C8=CC=C(C=C8)C(C)(C)C)C(C)(C)C)C9=CC=CC=C9

InChI

InChI=1S/C62H62/c1-59(2,3)43-27-23-41(24-28-43)57-51-35-45(61(7,8)9)31-33-47(51)49-38-54-50(37-53(49)55(57)39-19-15-13-16-20-39)48-34-32-46(62(10,11)12)36-52(48)58(56(54)40-21-17-14-18-22-40)42-25-29-44(30-26-42)60(4,5)6/h13-38H,1-12H3