2,8-ditert-butyl-5,11-bis(4-tert-butylphenyl)-6,12-bis(4-methoxyphenyl)tetracene

Systemtic Name: 2,8-ditert-butyl-5,11-bis(4-tert-butylphenyl)-6,12-bis(4-methoxyphenyl)tetracene Openeye Name: 2,8-ditert-butyl-5,11-bis(4-tert-butylphenyl)-6,12-bis(4-methoxyphenyl)tetracene CAS Name: 2,8-ditert-butyl-5,11-bis(4-tert-butylphenyl)-6,12-bis(4-methoxyphenyl)tetracene IUPAC Name: 2,8-ditert-butyl-5,11-bis(4-tert-butylphenyl)-6,12-bis(4-methoxyphenyl)tetracene Traditional Name: 2,8-ditert-butyl-5,11-bis(4-tert-butylphenyl)-6,12-bis(4-methoxyphenyl)tetracene Formula: C60H64O2 MolecularWeight: 817.14896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=C3C(=C4C=C(C=CC4=C(C3=C(C5=C2C=CC(=C5)C(C)(C)C)C6=CC=C(C=C6)OC)C7=CC=C(C=C7)C(C)(C)C)C(C)(C)C)C8=CC=C(C=C8)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=C3C(=C4C=C(C=CC4=C(C3=C(C5=C2C=CC(=C5)C(C)(C)C)C6=CC=C(C=C6)OC)C7=CC=C(C=C7)C(C)(C)C)C(C)(C)C)C8=CC=C(C=C8)OC

InChI

InChI=1S/C60H64O2/c1-57(2,3)41-23-15-37(16-24-41)51-47-33-27-43(59(7,8)9)35-49(47)54(40-21-31-46(62-14)32-22-40)56-52(38-17-25-42(26-18-38)58(4,5)6)48-34-28-44(60(10,11)12)36-50(48)53(55(51)56)39-19-29-45(61-13)30-20-39/h15-36H,1-14H3