1-(3-phenylpropyl)-4-[1-(3-phenylpropyl)pyridin-1-ium-4-yl]pyridin-1-ium ditetrafluoroborate

Systemtic Name: 1-(3-phenylpropyl)-4-[1-(3-phenylpropyl)pyridin-1-ium-4-yl]pyridin-1-ium ditetrafluoroborate Openeye Name: 1-(3-phenylpropyl)-4-[1-(3-phenylpropyl)pyridin-1-ium-4-yl]pyridin-1-ium ditetrafluoroborate CAS Name: 1-(3-phenylpropyl)-4-[1-(3-phenylpropyl)-4-pyridin-1-iumyl]pyridin-1-ium ditetrafluoroborate IUPAC Name: 1-(3-phenylpropyl)-4-[1-(3-phenylpropyl)pyridin-1-ium-4-yl]pyridin-1-ium ditetrafluoroborate Traditional Name: 1-(3-phenylpropyl)-4-[1-(3-phenylpropyl)pyridin-1-ium-4-yl]pyridin-1-ium ditetrafluoroborate Formula: C28H30B2F8N2 MolecularWeight: 568.160426

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.[B-](F)(F)(F)F.C1=CC=C(C=C1)CCC[N+]2=CC=C(C=C2)C3=CC=[N+](C=C3)CCCC4=CC=CC=C4

Isomeric SMILES

[B-](F)(F)(F)F.[B-](F)(F)(F)F.C1=CC=C(C=C1)CCC[N+]2=CC=C(C=C2)C3=CC=[N+](C=C3)CCCC4=CC=CC=C4

InChI

InChI=1S/C28H30N2.2BF4/c1-3-9-25(10-4-1)13-7-19-29-21-15-27(16-22-29)28-17-23-30(24-18-28)20-8-14-26-11-5-2-6-12-26;2*2-1(3,4)5/h1-6,9-12,15-18,21-24H,7-8,13-14,19-20H2;;/q+2;2*-1