(6E)-6-(3-pyren-1-yl-1H-imidazo[4,5-b]pyridin-2-ylidene)cyclohexa-2,4-dien-1-one; zinc

Systemtic Name: (6E)-6-(3-pyren-1-yl-1H-imidazo[4,5-b]pyridin-2-ylidene)cyclohexa-2,4-dien-1-one; zinc Openeye Name: (6E)-6-(3-pyren-1-yl-1H-imidazo[4,5-b]pyridin-2-ylidene)cyclohexa-2,4-dien-1-one; zinc CAS Name: (6E)-6-[3-(1-pyrenyl)-1H-imidazo[4,5-b]pyridin-2-ylidene]-1-cyclohexa-2,4-dienone; zinc IUPAC Name: (6E)-6-(3-pyren-1-yl-1H-imidazo[4,5-b]pyridin-2-ylidene)cyclohexa-2,4-dien-1-one; zinc Traditional Name: (6E)-6-(3-pyren-1-yl-1H-imidazo[4,5-b]pyridin-2-ylidene)cyclohexa-2,4-dien-1-one; zinc Formula: C28H17N3OZn MolecularWeight: 476.86308

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2NC3=C(N2C4=C5C=CC6=CC=CC7=C6C5=C(C=C7)C=C4)N=CC=C3)C(=O)C=C1.[Zn]

Isomeric SMILES

C1=C/C(=C\2/NC3=C(N2C4=C5C=CC6=CC=CC7=C6C5=C(C=C7)C=C4)N=CC=C3)/C(=O)C=C1.[Zn]

InChI

InChI=1S/C28H17N3O.Zn/c32-24-9-2-1-7-21(24)27-30-22-8-4-16-29-28(22)31(27)23-15-13-19-11-10-17-5-3-6-18-12-14-20(23)26(19)25(17)18;/h1-16,30H;/b27-21+;