2-[2-(trifluoromethyl)-3H-benzimidazol-1-ium-1-yl]ethanoate

Systemtic Name: 2-[2-(trifluoromethyl)-3H-benzimidazol-1-ium-1-yl]ethanoate Openeye Name: 2-[2-(trifluoromethyl)-3H-benzimidazol-1-ium-1-yl]acetate CAS Name: 2-[2-(trifluoromethyl)-3H-benzimidazol-1-ium-1-yl]acetate IUPAC Name: 2-[2-(trifluoromethyl)-3H-benzimidazol-1-ium-1-yl]acetate Traditional Name: 2-[2-(trifluoromethyl)-3H-benzimidazol-1-ium-1-yl]acetate Formula: C10H7F3N2O2 MolecularWeight: 244.16999

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=[N+]2CC(=O)[O-])C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)NC(=[N+]2CC(=O)[O-])C(F)(F)F

InChI

InChI=1S/C10H7F3N2O2/c11-10(12,13)9-14-6-3-1-2-4-7(6)15(9)5-8(16)17/h1-4H,5H2,(H,16,17)