1,5-bis(chloranyl)-9,10-bis(2,6-ditert-butylanthracen-9-yl)anthracene

Systemtic Name: 1,5-bis(chloranyl)-9,10-bis(2,6-ditert-butylanthracen-9-yl)anthracene Openeye Name: 1,5-dichloro-9,10-bis(2,6-ditert-butyl-9-anthryl)anthracene CAS Name: 1,5-dichloro-9,10-bis(2,6-ditert-butyl-9-anthracenyl)anthracene IUPAC Name: 1,5-dichloro-9,10-bis(2,6-ditert-butylanthracen-9-yl)anthracene Traditional Name: 1,5-dichloro-9,10-bis(2,6-ditert-butyl-9-anthryl)anthracene Formula: C58H56Cl2 MolecularWeight: 823.97124

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)C(=C3C=C(C=CC3=C2)C(C)(C)C)C4=C5C=CC=C(C5=C(C6=C4C(=CC=C6)Cl)C7=C8C=C(C=CC8=CC9=C7C=CC(=C9)C(C)(C)C)C(C)(C)C)Cl

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)C(=C3C=C(C=CC3=C2)C(C)(C)C)C4=C5C=CC=C(C5=C(C6=C4C(=CC=C6)Cl)C7=C8C=C(C=CC8=CC9=C7C=CC(=C9)C(C)(C)C)C(C)(C)C)Cl

InChI

InChI=1S/C58H56Cl2/c1-55(2,3)37-23-25-41-35(29-37)27-33-19-21-39(57(7,8)9)31-45(33)49(41)53-43-15-13-18-48(60)52(43)54(44-16-14-17-47(59)51(44)53)50-42-26-24-38(56(4,5)6)30-36(42)28-34-20-22-40(32-46(34)50)58(10,11)12/h13-32H,1-12H3