1-[2-(3-azanylpyridin-1-ium-1-yl)ethyl]pyridin-1-ium-3-amine ditetrafluoroborate

Systemtic Name: 1-[2-(3-azanylpyridin-1-ium-1-yl)ethyl]pyridin-1-ium-3-amine ditetrafluoroborate Openeye Name: 1-[2-(3-aminopyridin-1-ium-1-yl)ethyl]pyridin-1-ium-3-amine ditetrafluoroborate CAS Name: 1-[2-(3-amino-1-pyridin-1-iumyl)ethyl]-3-pyridin-1-iumamine ditetrafluoroborate IUPAC Name: 1-[2-(3-aminopyridin-1-ium-1-yl)ethyl]pyridin-1-ium-3-amine ditetrafluoroborate Traditional Name: [1-[2-(3-aminopyridin-1-ium-1-yl)ethyl]pyridin-1-ium-3-yl]amine ditetrafluoroborate Formula: C12H16B2F8N4 MolecularWeight: 389.891466

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16N4.2BF4/c13-11-3-1-5-15(9-11)7-8-16-6-2-4-12(14)10-16;2*2-1(3,4)5/h1-6,9-10H,7-8,13-14H2;;/q+2;2*-1