4-[8-(2,6-dipyridin-2-ylpyridin-4-yl)anthracen-1-yl]-2,6-dipyridin-2-yl-pyridine

Systemtic Name: 4-[8-(2,6-dipyridin-2-ylpyridin-4-yl)anthracen-1-yl]-2,6-dipyridin-2-yl-pyridine Openeye Name: 4-[8-[2,6-bis(2-pyridyl)-4-pyridyl]-1-anthryl]-2,6-bis(2-pyridyl)pyridine CAS Name: 4-[8-[2,6-bis(2-pyridinyl)-4-pyridinyl]-1-anthracenyl]-2,6-bis(2-pyridinyl)pyridine IUPAC Name: 4-[8-(2,6-dipyridin-2-ylpyridin-4-yl)anthracen-1-yl]-2,6-dipyridin-2-ylpyridine Traditional Name: 4-[8-[2,6-bis(2-pyridyl)-4-pyridyl]-1-anthryl]-2,6-bis(2-pyridyl)pyridine Formula: C44H28N6 MolecularWeight: 640.73332

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C2=CC(=CC(=N2)C3=CC=CC=N3)C4=CC=CC5=CC6=C(C=C54)C(=CC=C6)C7=CC(=NC(=C7)C8=CC=CC=N8)C9=CC=CC=N9

Isomeric SMILES

C1=CC=NC(=C1)C2=CC(=CC(=N2)C3=CC=CC=N3)C4=CC=CC5=CC6=C(C=C54)C(=CC=C6)C7=CC(=NC(=C7)C8=CC=CC=N8)C9=CC=CC=N9

InChI

InChI=1S/C44H28N6/c1-5-19-45-37(15-1)41-24-31(25-42(49-41)38-16-2-6-20-46-38)33-13-9-11-29-23-30-12-10-14-34(36(30)28-35(29)33)32-26-43(39-17-3-7-21-47-39)50-44(27-32)40-18-4-8-22-48-40/h1-28H