3-(4-phenyl-6-pyridin-1-ium-3-yl-pyrylium-2-yl)pyridin-1-ium tritetrafluoroborate

Systemtic Name: 3-(4-phenyl-6-pyridin-1-ium-3-yl-pyrylium-2-yl)pyridin-1-ium tritetrafluoroborate Openeye Name: 3-(4-phenyl-6-pyridin-1-ium-3-yl-pyrylium-2-yl)pyridin-1-ium tritetrafluoroborate CAS Name: 3-[4-phenyl-6-(3-pyridin-1-iumyl)-2-pyryliumyl]pyridin-1-ium tritetrafluoroborate IUPAC Name: 3-(4-phenyl-6-pyridin-1-ium-3-ylpyrylium-2-yl)pyridin-1-ium tritetrafluoroborate Traditional Name: 3-(4-phenyl-6-pyridin-1-ium-3-yl-pyrylium-2-yl)pyridin-1-ium tritetrafluoroborate Formula: C21H17B3F12N2O MolecularWeight: 573.786318

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.[B-](F)(F)(F)F.[B-](F)(F)(F)F.C1=CC=C(C=C1)C2=CC(=[O+]C(=C2)C3=C[NH+]=CC=C3)C4=C[NH+]=CC=C4

Isomeric SMILES

[B-](F)(F)(F)F.[B-](F)(F)(F)F.[B-](F)(F)(F)F.C1=CC=C(C=C1)C2=CC(=[O+]C(=C2)C3=C[NH+]=CC=C3)C4=C[NH+]=CC=C4

InChI

InChI=1S/C21H15N2O.3BF4/c1-2-6-16(7-3-1)19-12-20(17-8-4-10-22-14-17)24-21(13-19)18-9-5-11-23-15-18;3*2-1(3,4)5/h1-15H;;;/q+1;3*-1/p+2