3,6,9-tris(4-carbazol-9-ylphenyl)carbazole

Systemtic Name: 3,6,9-tris(4-carbazol-9-ylphenyl)carbazole Openeye Name: 3,6,9-tris(4-carbazol-9-ylphenyl)carbazole CAS Name: 3,6,9-tris[4-(9-carbazolyl)phenyl]carbazole IUPAC Name: 3,6,9-tris(4-carbazol-9-ylphenyl)carbazole Traditional Name: 3,6,9-tris(4-carbazol-9-ylphenyl)carbazole Formula: C66H42N4 MolecularWeight: 891.06648

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=CC=CC=C3N2C4=CC=C(C=C4)C5=CC6=C(C=C5)N(C7=C6C=C(C=C7)C8=CC=C(C=C8)N9C1=CC=CC=C1C1=CC=CC=C19)C1=CC=C(C=C1)N1C2=CC=CC=C2C2=CC=CC=C21

Isomeric SMILES

C1=CC=C2C(=C1)C3=CC=CC=C3N2C4=CC=C(C=C4)C5=CC6=C(C=C5)N(C7=C6C=C(C=C7)C8=CC=C(C=C8)N9C1=CC=CC=C1C1=CC=CC=C19)C1=CC=C(C=C1)N1C2=CC=CC=C2C2=CC=CC=C21

InChI

InChI=1S/C66H42N4/c1-7-19-59-51(13-1)52-14-2-8-20-60(52)67(59)47-31-25-43(26-32-47)45-29-39-65-57(41-45)58-42-46(44-27-33-48(34-28-44)68-61-21-9-3-15-53(61)54-16-4-10-22-62(54)68)30-40-66(58)70(65)50-37-35-49(36-38-50)69-63-23-11-5-17-55(63)56-18-6-12-24-64(56)69/h1-42H