N3,N7-bis(9,9-dimethylfluoren-2-yl)-N3,N7-diphenyl-dibenzothiophene-3,7-diamine

Systemtic Name: N3,N7-bis(9,9-dimethylfluoren-2-yl)-N3,N7-diphenyl-dibenzothiophene-3,7-diamine Openeye Name: N3,N7-bis(9,9-dimethylfluoren-2-yl)-N3,N7-diphenyl-dibenzothiophene-3,7-diamine CAS Name: N3,N7-bis(9,9-dimethyl-2-fluorenyl)-N3,N7-diphenyldibenzothiophene-3,7-diamine IUPAC Name: 3-N,7-N-bis(9,9-dimethylfluoren-2-yl)-3-N,7-N-diphenyldibenzothiophene-3,7-diamine Traditional Name: (9,9-dimethylfluoren-2-yl)-[7-(N-(9,9-dimethylfluoren-2-yl)anilino)dibenzothiophen-3-yl]-phenyl-amine Formula: C54H42N2S MolecularWeight: 750.98968

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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=C(C=C5)C7=C(S6)C=C(C=C7)N(C8=CC=CC=C8)C9=CC1=C(C=C9)C2=CC=CC=C2C1(C)C)C

Isomeric SMILES

CC1(C2=CC=CC=C2C3=C1C=C(C=C3)N(C4=CC=CC=C4)C5=CC6=C(C=C5)C7=C(S6)C=C(C=C7)N(C8=CC=CC=C8)C9=CC1=C(C=C9)C2=CC=CC=C2C1(C)C)C

InChI

InChI=1S/C54H42N2S/c1-53(2)47-21-13-11-19-41(47)43-27-23-37(31-49(43)53)55(35-15-7-5-8-16-35)39-25-29-45-46-30-26-40(34-52(46)57-51(45)33-39)56(36-17-9-6-10-18-36)38-24-28-44-42-20-12-14-22-48(42)54(3,4)50(44)32-38/h5-34H,1-4H3