1-ethenyl-3-[[(2S)-6-fluoranyl-2-phenyl-4H-1,3-benzodioxin-8-yl]methyl]benzimidazol-3-ium

Systemtic Name: 1-ethenyl-3-[[(2S)-6-fluoranyl-2-phenyl-4H-1,3-benzodioxin-8-yl]methyl]benzimidazol-3-ium Openeye Name: 1-[[(2S)-6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl]methyl]-3-vinyl-benzimidazol-1-ium CAS Name: 1-ethenyl-3-[[(2S)-6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl]methyl]benzimidazol-3-ium IUPAC Name: 1-ethenyl-3-[[(2S)-6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl]methyl]benzimidazol-3-ium Traditional Name: 1-[[(2S)-6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl]methyl]-3-vinyl-benzimidazol-1-ium Formula: C24H20FN2O2+ MolecularWeight: 387.426203

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Descriptors Computed from Structure

Canonical SMILES:

C=CN1C=[N+](C2=CC=CC=C21)CC3=C4C(=CC(=C3)F)COC(O4)C5=CC=CC=C5

Isomeric SMILES

C=CN1C=[N+](C2=CC=CC=C21)CC3=C4C(=CC(=C3)F)CO[C@@H](O4)C5=CC=CC=C5

InChI

InChI=1S/C24H20FN2O2/c1-2-26-16-27(22-11-7-6-10-21(22)26)14-18-12-20(25)13-19-15-28-24(29-23(18)19)17-8-4-3-5-9-17/h2-13,16,24H,1,14-15H2/q+1/t24-/m0/s1