4-pyridin-4-yl-1-[3-(4-pyridin-4-ylpyridin-1-ium-1-yl)propyl]pyridin-1-ium dihexafluorophosphate

Systemtic Name: 4-pyridin-4-yl-1-[3-(4-pyridin-4-ylpyridin-1-ium-1-yl)propyl]pyridin-1-ium dihexafluorophosphate Openeye Name: 4-(4-pyridyl)-1-[3-[4-(4-pyridyl)pyridin-1-ium-1-yl]propyl]pyridin-1-ium dihexafluorophosphate CAS Name: 4-pyridin-4-yl-1-[3-(4-pyridin-4-yl-1-pyridin-1-iumyl)propyl]pyridin-1-ium dihexafluorophosphate IUPAC Name: 4-pyridin-4-yl-1-[3-(4-pyridin-4-ylpyridin-1-ium-1-yl)propyl]pyridin-1-ium dihexafluorophosphate Traditional Name: 4-(4-pyridyl)-1-[3-[4-(4-pyridyl)pyridin-1-ium-1-yl]propyl]pyridin-1-ium dihexafluorophosphate Formula: C23H22F12N4P2 MolecularWeight: 644.37594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CC=C1C2=CC=[N+](C=C2)CCC[N+]3=CC=C(C=C3)C4=CC=NC=C4.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F

Isomeric SMILES

C1=CN=CC=C1C2=CC=[N+](C=C2)CCC[N+]3=CC=C(C=C3)C4=CC=NC=C4.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F

InChI

InChI=1S/C23H22N4.2F6P/c1(14-26-16-6-22(7-17-26)20-2-10-24-11-3-20)15-27-18-8-23(9-19-27)21-4-12-25-13-5-21;2*1-7(2,3,4,5)6/h2-13,16-19H,1,14-15H2;;/q+2;2*-1