3,6-ditert-butyl-9-ethyl-1,8-bis(10-phenylanthracen-9-yl)carbazole

Systemtic Name: 3,6-ditert-butyl-9-ethyl-1,8-bis(10-phenylanthracen-9-yl)carbazole Openeye Name: 3,6-ditert-butyl-9-ethyl-1,8-bis(10-phenyl-9-anthryl)carbazole CAS Name: 3,6-ditert-butyl-9-ethyl-1,8-bis(10-phenyl-9-anthracenyl)carbazole IUPAC Name: 3,6-ditert-butyl-9-ethyl-1,8-bis(10-phenylanthracen-9-yl)carbazole Traditional Name: 3,6-ditert-butyl-9-ethyl-1,8-bis(10-phenyl-9-anthryl)carbazole Formula: C62H53N MolecularWeight: 812.09092

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2C3=CC(=CC(=C31)C4=C5C=CC=CC5=C(C6=CC=CC=C64)C7=CC=CC=C7)C(C)(C)C)C(C)(C)C)C8=C9C=CC=CC9=C(C1=CC=CC=C18)C1=CC=CC=C1

Isomeric SMILES

CCN1C2=C(C=C(C=C2C3=CC(=CC(=C31)C4=C5C=CC=CC5=C(C6=CC=CC=C64)C7=CC=CC=C7)C(C)(C)C)C(C)(C)C)C8=C9C=CC=CC9=C(C1=CC=CC=C18)C1=CC=CC=C1

InChI

InChI=1S/C62H53N/c1-8-63-59-51(35-41(61(2,3)4)37-53(59)57-47-31-19-15-27-43(47)55(39-23-11-9-12-24-39)44-28-16-20-32-48(44)57)52-36-42(62(5,6)7)38-54(60(52)63)58-49-33-21-17-29-45(49)56(40-25-13-10-14-26-40)46-30-18-22-34-50(46)58/h9-38H,8H2,1-7H3