4-pyridin-4-yl-1-[7-(4-pyridin-4-ylpyridin-1-ium-1-yl)heptyl]pyridin-1-ium dihexafluorophosphate

Systemtic Name: 4-pyridin-4-yl-1-[7-(4-pyridin-4-ylpyridin-1-ium-1-yl)heptyl]pyridin-1-ium dihexafluorophosphate Openeye Name: 4-(4-pyridyl)-1-[7-[4-(4-pyridyl)pyridin-1-ium-1-yl]heptyl]pyridin-1-ium dihexafluorophosphate CAS Name: 4-pyridin-4-yl-1-[7-(4-pyridin-4-yl-1-pyridin-1-iumyl)heptyl]pyridin-1-ium dihexafluorophosphate IUPAC Name: 4-pyridin-4-yl-1-[7-(4-pyridin-4-ylpyridin-1-ium-1-yl)heptyl]pyridin-1-ium dihexafluorophosphate Traditional Name: 4-(4-pyridyl)-1-[7-[4-(4-pyridyl)pyridin-1-ium-1-yl]heptyl]pyridin-1-ium dihexafluorophosphate Formula: C27H30F12N4P2 MolecularWeight: 700.48226

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CC=C1C2=CC=[N+](C=C2)CCCCCCC[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)CCCCCCC[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/C27H30N4.2F6P/c1(2-4-18-30-20-10-26(11-21-30)24-6-14-28-15-7-24)3-5-19-31-22-12-27(13-23-31)25-8-16-29-17-9-25;2*1-7(2,3,4,5)6/h6-17,20-23H,1-5,18-19H2;;/q+2;2*-1