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

Systemtic Name: N-(2,4,6-triphenylpyridin-1-ium-1-yl)butan-2-imine tetrafluoroborate Openeye Name: N-(2,4,6-triphenylpyridin-1-ium-1-yl)butan-2-imine tetrafluoroborate CAS Name: N-(2,4,6-triphenyl-1-pyridin-1-iumyl)-2-butanimine tetrafluoroborate IUPAC Name: N-(2,4,6-triphenylpyridin-1-ium-1-yl)butan-2-imine tetrafluoroborate Traditional Name: (E)-1-methylpropylidene-(2,4,6-triphenylpyridin-1-ium-1-yl)amine tetrafluoroborate Formula: C27H25BF4N2 MolecularWeight: 464.305413

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C27H25N2.BF4/c1-3-21(2)28-29-26(23-15-9-5-10-16-23)19-25(22-13-7-4-8-14-22)20-27(29)24-17-11-6-12-18-24;2-1(3,4)5/h4-20H,3H2,1-2H3;/q+1;-1/b28-21+;