4-(4-phenyl-2,6-dipyridin-3-yl-pyridin-1-ium-1-yl)-2,6-dipyridin-3-yl-phenol tetrafluoroborate

Systemtic Name: 4-(4-phenyl-2,6-dipyridin-3-yl-pyridin-1-ium-1-yl)-2,6-dipyridin-3-yl-phenol tetrafluoroborate Openeye Name: 4-[4-phenyl-2,6-bis(3-pyridyl)pyridin-1-ium-1-yl]-2,6-bis(3-pyridyl)phenol tetrafluoroborate CAS Name: 4-[4-phenyl-2,6-bis(3-pyridinyl)-1-pyridin-1-iumyl]-2,6-bis(3-pyridinyl)phenol tetrafluoroborate IUPAC Name: 4-(4-phenyl-2,6-dipyridin-3-ylpyridin-1-ium-1-yl)-2,6-dipyridin-3-ylphenol tetrafluoroborate Traditional Name: 4-[4-phenyl-2,6-bis(3-pyridyl)pyridin-1-ium-1-yl]-2,6-bis(3-pyridyl)phenol tetrafluoroborate Formula: C37H26BF4N5O MolecularWeight: 643.439853

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.C1=CC=C(C=C1)C2=CC(=[N+](C(=C2)C3=CN=CC=C3)C4=CC(=C(C(=C4)C5=CN=CC=C5)O)C6=CN=CC=C6)C7=CN=CC=C7

Isomeric SMILES

[B-](F)(F)(F)F.C1=CC=C(C=C1)C2=CC(=[N+](C(=C2)C3=CN=CC=C3)C4=CC(=C(C(=C4)C5=CN=CC=C5)O)C6=CN=CC=C6)C7=CN=CC=C7

InChI

InChI=1S/C37H25N5O.BF4/c43-37-33(27-10-4-14-38-22-27)20-32(21-34(37)28-11-5-15-39-23-28)42-35(29-12-6-16-40-24-29)18-31(26-8-2-1-3-9-26)19-36(42)30-13-7-17-41-25-30;2-1(3,4)5/h1-25H;/q;-1/p+1