5-(pyridin-1-ium-1-ylmethyl)-2-[5-(pyridin-1-ium-1-ylmethyl)pyridin-2-yl]pyridine dihexafluorophosphate

Systemtic Name: 5-(pyridin-1-ium-1-ylmethyl)-2-[5-(pyridin-1-ium-1-ylmethyl)pyridin-2-yl]pyridine dihexafluorophosphate Openeye Name: 5-(pyridin-1-ium-1-ylmethyl)-2-[5-(pyridin-1-ium-1-ylmethyl)-2-pyridyl]pyridine dihexafluorophosphate CAS Name: 5-(1-pyridin-1-iumylmethyl)-2-[5-(1-pyridin-1-iumylmethyl)-2-pyridinyl]pyridine dihexafluorophosphate IUPAC Name: 5-(pyridin-1-ium-1-ylmethyl)-2-[5-(pyridin-1-ium-1-ylmethyl)pyridin-2-yl]pyridine dihexafluorophosphate Traditional Name: 5-(pyridin-1-ium-1-ylmethyl)-2-[5-(pyridin-1-ium-1-ylmethyl)-2-pyridyl]pyridine dihexafluorophosphate Formula: C22H20F12N4P2 MolecularWeight: 630.34936

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C=C1)CC2=CN=C(C=C2)C3=NC=C(C=C3)C[N+]4=CC=CC=C4.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F

Isomeric SMILES

C1=CC=[N+](C=C1)CC2=CN=C(C=C2)C3=NC=C(C=C3)C[N+]4=CC=CC=C4.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F

InChI

InChI=1S/C22H20N4.2F6P/c1-3-11-25(12-4-1)17-19-7-9-21(23-15-19)22-10-8-20(16-24-22)18-26-13-5-2-6-14-26;2*1-7(2,3,4,5)6/h1-16H,17-18H2;;/q+2;2*-1