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

Systemtic Name: 4-(4-phenyl-6-pyridin-1-ium-4-yl-pyrylium-2-yl)pyridin-1-ium tritetrafluoroborate Openeye Name: 4-(4-phenyl-6-pyridin-1-ium-4-yl-pyrylium-2-yl)pyridin-1-ium tritetrafluoroborate CAS Name: 4-[4-phenyl-6-(4-pyridin-1-iumyl)-2-pyryliumyl]pyridin-1-ium tritetrafluoroborate IUPAC Name: 4-(4-phenyl-6-pyridin-1-ium-4-ylpyrylium-2-yl)pyridin-1-ium tritetrafluoroborate Traditional Name: 4-(4-phenyl-6-pyridin-1-ium-4-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=CC=[NH+]C=C3)C4=CC=[NH+]C=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=CC=[NH+]C=C3)C4=CC=[NH+]C=C4

InChI

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