3,6-bis[4-(3,6-dimethylcarbazol-9-yl)phenyl]-9-(4-phenylphenyl)carbazole

Systemtic Name: 3,6-bis[4-(3,6-dimethylcarbazol-9-yl)phenyl]-9-(4-phenylphenyl)carbazole Openeye Name: 3,6-bis[4-(3,6-dimethylcarbazol-9-yl)phenyl]-9-(4-phenylphenyl)carbazole CAS Name: 3,6-bis[4-(3,6-dimethyl-9-carbazolyl)phenyl]-9-(4-phenylphenyl)carbazole IUPAC Name: 3,6-bis[4-(3,6-dimethylcarbazol-9-yl)phenyl]-9-(4-phenylphenyl)carbazole Traditional Name: 3,6-bis[4-(3,6-dimethylcarbazol-9-yl)phenyl]-9-(4-phenylphenyl)carbazole Formula: C64H47N3 MolecularWeight: 858.07808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C3=C2C=C(C=C3)C)C4=CC=C(C=C4)C5=CC6=C(C=C5)N(C7=C6C=C(C=C7)C8=CC=C(C=C8)N9C1=C(C=C(C=C1)C)C1=C9C=CC(=C1)C)C1=CC=C(C=C1)C1=CC=CC=C1

Isomeric SMILES

CC1=CC2=C(C=C1)N(C3=C2C=C(C=C3)C)C4=CC=C(C=C4)C5=CC6=C(C=C5)N(C7=C6C=C(C=C7)C8=CC=C(C=C8)N9C1=C(C=C(C=C1)C)C1=C9C=CC(=C1)C)C1=CC=C(C=C1)C1=CC=CC=C1

InChI

InChI=1S/C64H47N3/c1-40-10-28-59-53(34-40)54-35-41(2)11-29-60(54)65(59)51-24-16-46(17-25-51)48-20-32-63-57(38-48)58-39-49(21-33-64(58)67(63)50-22-14-45(15-23-50)44-8-6-5-7-9-44)47-18-26-52(27-19-47)66-61-30-12-42(3)36-55(61)56-37-43(4)13-31-62(56)66/h5-39H,1-4H3