2-[[(2,4,6-triphenylpyridin-1-ium-1-yl)amino]methyl]benzenecarbonitrile tetrafluoroborate

Systemtic Name: 2-[[(2,4,6-triphenylpyridin-1-ium-1-yl)amino]methyl]benzenecarbonitrile tetrafluoroborate Openeye Name: 2-[[(2,4,6-triphenylpyridin-1-ium-1-yl)amino]methyl]benzonitrile tetrafluoroborate CAS Name: 2-[[(2,4,6-triphenyl-1-pyridin-1-iumyl)amino]methyl]benzonitrile tetrafluoroborate IUPAC Name: 2-[[(2,4,6-triphenylpyridin-1-ium-1-yl)amino]methyl]benzonitrile tetrafluoroborate Traditional Name: 2-[[(2,4,6-triphenylpyridin-1-ium-1-yl)amino]methyl]benzonitrile tetrafluoroborate Formula: C31H24BF4N3 MolecularWeight: 525.346973

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.C1=CC=C(C=C1)C2=CC(=[N+](C(=C2)C3=CC=CC=C3)NCC4=CC=CC=C4C#N)C5=CC=CC=C5

Isomeric SMILES

[B-](F)(F)(F)F.C1=CC=C(C=C1)C2=CC(=[N+](C(=C2)C3=CC=CC=C3)NCC4=CC=CC=C4C#N)C5=CC=CC=C5

InChI

InChI=1S/C31H24N3.BF4/c32-22-27-18-10-11-19-28(27)23-33-34-30(25-14-6-2-7-15-25)20-29(24-12-4-1-5-13-24)21-31(34)26-16-8-3-9-17-26;2-1(3,4)5/h1-21,33H,23H2;/q+1;-1