4-[4-[4-[4-(2,6-dipyridin-2-ylpyridin-4-yl)phenyl]buta-1,3-diynyl]phenyl]-2,6-dipyridin-2-yl-pyridine

Systemtic Name: 4-[4-[4-[4-(2,6-dipyridin-2-ylpyridin-4-yl)phenyl]buta-1,3-diynyl]phenyl]-2,6-dipyridin-2-yl-pyridine Openeye Name: 4-[4-[4-[4-[2,6-bis(2-pyridyl)-4-pyridyl]phenyl]buta-1,3-diynyl]phenyl]-2,6-bis(2-pyridyl)pyridine CAS Name: 4-[4-[4-[4-[2,6-bis(2-pyridinyl)-4-pyridinyl]phenyl]buta-1,3-diynyl]phenyl]-2,6-bis(2-pyridinyl)pyridine IUPAC Name: 4-[4-[4-[4-(2,6-dipyridin-2-ylpyridin-4-yl)phenyl]buta-1,3-diynyl]phenyl]-2,6-dipyridin-2-ylpyridine Traditional Name: 4-[4-[4-[4-[2,6-bis(2-pyridyl)-4-pyridyl]phenyl]buta-1,3-diynyl]phenyl]-2,6-bis(2-pyridyl)pyridine Formula: C46H28N6 MolecularWeight: 664.75472

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C2=CC(=CC(=N2)C3=CC=CC=N3)C4=CC=C(C=C4)C#CC#CC5=CC=C(C=C5)C6=CC(=NC(=C6)C7=CC=CC=N7)C8=CC=CC=N8

Isomeric SMILES

C1=CC=NC(=C1)C2=CC(=CC(=N2)C3=CC=CC=N3)C4=CC=C(C=C4)C#CC#CC5=CC=C(C=C5)C6=CC(=NC(=C6)C7=CC=CC=N7)C8=CC=CC=N8

InChI

InChI=1S/C46H28N6/c1(11-33-17-21-35(22-18-33)37-29-43(39-13-3-7-25-47-39)51-44(30-37)40-14-4-8-26-48-40)2-12-34-19-23-36(24-20-34)38-31-45(41-15-5-9-27-49-41)52-46(32-38)42-16-6-10-28-50-42/h3-10,13-32H