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

Systemtic Name: 2,8-ditert-butyl-5,11-bis(4-tert-butylphenyl)-6,12-bis(4-fluorophenyl)tetracene Openeye Name: 2,8-ditert-butyl-5,11-bis(4-tert-butylphenyl)-6,12-bis(4-fluorophenyl)tetracene CAS Name: 2,8-ditert-butyl-5,11-bis(4-tert-butylphenyl)-6,12-bis(4-fluorophenyl)tetracene IUPAC Name: 2,8-ditert-butyl-5,11-bis(4-tert-butylphenyl)-6,12-bis(4-fluorophenyl)tetracene Traditional Name: 2,8-ditert-butyl-5,11-bis(4-tert-butylphenyl)-6,12-bis(4-fluorophenyl)tetracene Formula: C58H58F2 MolecularWeight: 793.077926

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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)F)C7=CC=C(C=C7)C(C)(C)C)C(C)(C)C)C8=CC=C(C=C8)F

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)F)C7=CC=C(C=C7)C(C)(C)C)C(C)(C)C)C8=CC=C(C=C8)F

InChI

InChI=1S/C58H58F2/c1-55(2,3)39-21-13-35(14-22-39)49-45-31-25-41(57(7,8)9)33-47(45)52(38-19-29-44(60)30-20-38)54-50(36-15-23-40(24-16-36)56(4,5)6)46-32-26-42(58(10,11)12)34-48(46)51(53(49)54)37-17-27-43(59)28-18-37/h13-34H,1-12H3