2-[(E)-2-(1H-imidazol-2-yl)ethenyl]-1-propan-2-yl-pyridin-1-ium tetrafluoroborate

Systemtic Name: 2-[(E)-2-(1H-imidazol-2-yl)ethenyl]-1-propan-2-yl-pyridin-1-ium tetrafluoroborate Openeye Name: 2-[(E)-2-(1H-imidazol-2-yl)vinyl]-1-isopropyl-pyridin-1-ium tetrafluoroborate CAS Name: 2-[(E)-2-(1H-imidazol-2-yl)ethenyl]-1-propan-2-ylpyridin-1-ium tetrafluoroborate IUPAC Name: 2-[(E)-2-(1H-imidazol-2-yl)ethenyl]-1-propan-2-ylpyridin-1-ium tetrafluoroborate Traditional Name: 2-[(E)-2-(1H-imidazol-2-yl)vinyl]-1-isopropyl-pyridin-1-ium tetrafluoroborate Formula: C13H16BF4N3 MolecularWeight: 301.090853

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CC(C)[N+]1=CC=CC=C1C=CC2=NC=CN2

Isomeric SMILES

[B-](F)(F)(F)F.CC(C)[N+]1=CC=CC=C1/C=C/C2=NC=CN2

InChI

InChI=1S/C13H15N3.BF4/c1-11(2)16-10-4-3-5-12(16)6-7-13-14-8-9-15-13;2-1(3,4)5/h3-11H,1-2H3;/q;-1/p+1