N-(2,4,6-triphenylpyridin-1-ium-1-yl)pentan-3-imine tetrafluoroborate

Systemtic Name: N-(2,4,6-triphenylpyridin-1-ium-1-yl)pentan-3-imine tetrafluoroborate Openeye Name: N-(2,4,6-triphenylpyridin-1-ium-1-yl)pentan-3-imine tetrafluoroborate CAS Name: N-(2,4,6-triphenyl-1-pyridin-1-iumyl)-3-pentanimine tetrafluoroborate IUPAC Name: N-(2,4,6-triphenylpyridin-1-ium-1-yl)pentan-3-imine tetrafluoroborate Traditional Name: 1-ethylpropylidene-(2,4,6-triphenylpyridin-1-ium-1-yl)amine tetrafluoroborate Formula: C28H27BF4N2 MolecularWeight: 478.331993

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CCC(=N[N+]1=C(C=C(C=C1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4)CC

Isomeric SMILES

[B-](F)(F)(F)F.CCC(=N[N+]1=C(C=C(C=C1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4)CC

InChI

InChI=1S/C28H27N2.BF4/c1-3-26(4-2)29-30-27(23-16-10-6-11-17-23)20-25(22-14-8-5-9-15-22)21-28(30)24-18-12-7-13-19-24;2-1(3,4)5/h5-21H,3-4H2,1-2H3;/q+1;-1