3-methyl-2-(trifluoromethyl)-1H-benzimidazol-3-ium

Systemtic Name: 3-methyl-2-(trifluoromethyl)-1H-benzimidazol-3-ium Openeye Name: 3-methyl-2-(trifluoromethyl)-1H-benzimidazol-3-ium CAS Name: 3-methyl-2-(trifluoromethyl)-1H-benzimidazol-3-ium IUPAC Name: 3-methyl-2-(trifluoromethyl)-1H-benzimidazol-3-ium Traditional Name: 3-methyl-2-(trifluoromethyl)-1H-benzimidazol-3-ium Formula: C9H8F3N2+ MolecularWeight: 201.16843

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(NC2=CC=CC=C21)C(F)(F)F

Isomeric SMILES

C[N+]1=C(NC2=CC=CC=C21)C(F)(F)F

InChI

InChI=1S/C9H7F3N2/c1-14-7-5-3-2-4-6(7)13-8(14)9(10,11)12/h2-5H,1H3/p+1