N4,N9-bis(9,9-dimethylfluoren-2-yl)-N4,N9-diphenyl-pyrene-4,9-diamine

Systemtic Name: N4,N9-bis(9,9-dimethylfluoren-2-yl)-N4,N9-diphenyl-pyrene-4,9-diamine Openeye Name: N4,N9-bis(9,9-dimethylfluoren-2-yl)-N4,N9-diphenyl-pyrene-4,9-diamine CAS Name: N4,N9-bis(9,9-dimethyl-2-fluorenyl)-N4,N9-diphenylpyrene-4,9-diamine IUPAC Name: 4-N,9-N-bis(9,9-dimethylfluoren-2-yl)-4-N,9-N-diphenylpyrene-4,9-diamine Traditional Name: (9,9-dimethylfluoren-2-yl)-[9-(N-(9,9-dimethylfluoren-2-yl)anilino)pyren-4-yl]-phenyl-amine Formula: C58H44N2 MolecularWeight: 768.98336

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC=CC=C2C3=C1C=C(C=C3)N(C4=CC=CC=C4)C5=CC6=C7C(=CC=C6)C(=CC8=C7C5=CC=C8)N(C9=CC=CC=C9)C1=CC2=C(C=C1)C1=CC=CC=C1C2(C)C)C

Isomeric SMILES

CC1(C2=CC=CC=C2C3=C1C=C(C=C3)N(C4=CC=CC=C4)C5=CC6=C7C(=CC=C6)C(=CC8=C7C5=CC=C8)N(C9=CC=CC=C9)C1=CC2=C(C=C1)C1=CC=CC=C1C2(C)C)C

InChI

InChI=1S/C58H44N2/c1-57(2)49-27-13-11-23-43(49)45-31-29-41(35-51(45)57)59(39-19-7-5-8-20-39)53-33-37-17-16-26-48-54(34-38-18-15-25-47(53)55(38)56(37)48)60(40-21-9-6-10-22-40)42-30-32-46-44-24-12-14-28-50(44)58(3,4)52(46)36-42/h5-36H,1-4H3