1-(4-methylphenyl)-N-(2,4,6-triphenylpyridin-1-ium-1-yl)methanimine tetrafluoroborate

Systemtic Name: 1-(4-methylphenyl)-N-(2,4,6-triphenylpyridin-1-ium-1-yl)methanimine tetrafluoroborate Openeye Name: 1-(p-tolyl)-N-(2,4,6-triphenylpyridin-1-ium-1-yl)methanimine tetrafluoroborate CAS Name: 1-(4-methylphenyl)-N-(2,4,6-triphenyl-1-pyridin-1-iumyl)methanimine tetrafluoroborate IUPAC Name: 1-(4-methylphenyl)-N-(2,4,6-triphenylpyridin-1-ium-1-yl)methanimine tetrafluoroborate Traditional Name: (E)-(4-methylbenzylidene)-(2,4,6-triphenylpyridin-1-ium-1-yl)amine tetrafluoroborate Formula: C31H25BF4N2 MolecularWeight: 512.348213

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CC1=CC=C(C=C1)C=N[N+]2=C(C=C(C=C2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

[B-](F)(F)(F)F.CC1=CC=C(C=C1)/C=N/[N+]2=C(C=C(C=C2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H25N2.BF4/c1-24-17-19-25(20-18-24)23-32-33-30(27-13-7-3-8-14-27)21-29(26-11-5-2-6-12-26)22-31(33)28-15-9-4-10-16-28;2-1(3,4)5/h2-23H,1H3;/q+1;-1/b32-23+;