9-[3,6,8-tri(carbazol-9-yl)pyren-1-yl]carbazole

Systemtic Name: 9-[3,6,8-tri(carbazol-9-yl)pyren-1-yl]carbazole Openeye Name: 9-[3,6,8-tri(carbazol-9-yl)pyren-1-yl]carbazole CAS Name: 9-[3,6,8-tris(9-carbazolyl)-1-pyrenyl]carbazole IUPAC Name: 9-[3,6,8-tri(carbazol-9-yl)pyren-1-yl]carbazole Traditional Name: 9-[3,6,8-tri(carbazol-9-yl)pyren-1-yl]carbazole Formula: C64H38N4 MolecularWeight: 863.01332

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=CC=CC=C3N2C4=CC(=C5C=CC6=C(C=C(C7=C6C5=C4C=C7)N8C9=CC=CC=C9C1=CC=CC=C18)N1C2=CC=CC=C2C2=CC=CC=C21)N1C2=CC=CC=C2C2=CC=CC=C21

Isomeric SMILES

C1=CC=C2C(=C1)C3=CC=CC=C3N2C4=CC(=C5C=CC6=C(C=C(C7=C6C5=C4C=C7)N8C9=CC=CC=C9C1=CC=CC=C18)N1C2=CC=CC=C2C2=CC=CC=C21)N1C2=CC=CC=C2C2=CC=CC=C21

InChI

InChI=1S/C64H38N4/c1-9-25-51-39(17-1)40-18-2-10-26-52(40)65(51)59-37-60(66-53-27-11-3-19-41(53)42-20-4-12-28-54(42)66)48-35-36-50-62(68-57-31-15-7-23-45(57)46-24-8-16-32-58(46)68)38-61(49-34-33-47(59)63(48)64(49)50)67-55-29-13-5-21-43(55)44-22-6-14-30-56(44)67/h1-38H