2-(4,5-diphenyl-2-pyren-1-yl-imidazol-2-yl)-4,5-diphenyl-2-pyren-1-yl-imidazole

Systemtic Name: 2-(4,5-diphenyl-2-pyren-1-yl-imidazol-2-yl)-4,5-diphenyl-2-pyren-1-yl-imidazole Openeye Name: 2-(4,5-diphenyl-2-pyren-1-yl-imidazol-2-yl)-4,5-diphenyl-2-pyren-1-yl-imidazole CAS Name: 2-[4,5-diphenyl-2-(1-pyrenyl)-2-imidazolyl]-4,5-diphenyl-2-(1-pyrenyl)imidazole IUPAC Name: 2-(4,5-diphenyl-2-pyren-1-ylimidazol-2-yl)-4,5-diphenyl-2-pyren-1-ylimidazole Traditional Name: 2-(4,5-diphenyl-2-pyren-1-yl-imidazol-2-yl)-4,5-diphenyl-2-pyren-1-yl-imidazole Formula: C62H38N4 MolecularWeight: 838.99192

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(N=C2C3=CC=CC=C3)(C4=C5C=CC6=CC=CC7=C6C5=C(C=C7)C=C4)C8(N=C(C(=N8)C9=CC=CC=C9)C1=CC=CC=C1)C1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C=C1

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(N=C2C3=CC=CC=C3)(C4=C5C=CC6=CC=CC7=C6C5=C(C=C7)C=C4)C8(N=C(C(=N8)C9=CC=CC=C9)C1=CC=CC=C1)C1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C=C1

InChI

InChI=1S/C62H38N4/c1-5-15-45(16-6-1)57-58(46-17-7-2-8-18-46)64-61(63-57,51-37-33-43-29-27-39-23-13-25-41-31-35-49(51)55(43)53(39)41)62(65-59(47-19-9-3-10-20-47)60(66-62)48-21-11-4-12-22-48)52-38-34-44-30-28-40-24-14-26-42-32-36-50(52)56(44)54(40)42/h1-38H