2-(1H-benzimidazol-3-ium-2-yl)ethanoate

Systemtic Name: 2-(1H-benzimidazol-3-ium-2-yl)ethanoate Openeye Name: 2-(1H-benzimidazol-3-ium-2-yl)acetate CAS Name: 2-(1H-benzimidazol-3-ium-2-yl)acetate IUPAC Name: 2-(1H-benzimidazol-3-ium-2-yl)acetate Traditional Name: 2-(1H-benzimidazol-3-ium-2-yl)acetate Formula: C9H8N2O2 MolecularWeight: 176.17202

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=[NH+]2)CC(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)NC(=[NH+]2)CC(=O)[O-]

InChI

InChI=1S/C9H8N2O2/c12-9(13)5-8-10-6-3-1-2-4-7(6)11-8/h1-4H,5H2,(H,10,11)(H,12,13)