2-[2-[2-(methylazaniumyl)ethyl]benzimidazol-1-yl]ethanoate

Systemtic Name: 2-[2-[2-(methylazaniumyl)ethyl]benzimidazol-1-yl]ethanoate Openeye Name: 2-[2-[2-(methylammonio)ethyl]benzimidazol-1-yl]acetate CAS Name: 2-[2-[2-(methylammonio)ethyl]-1-benzimidazolyl]acetate IUPAC Name: 2-[2-[2-(methylazaniumyl)ethyl]benzimidazol-1-yl]acetate Traditional Name: 2-[2-[2-(methylammonio)ethyl]benzimidazol-1-yl]acetate Formula: C12H15N3O2 MolecularWeight: 233.2664

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Descriptors Computed from Structure

Canonical SMILES:

C[NH2+]CCC1=NC2=CC=CC=C2N1CC(=O)[O-]

Isomeric SMILES

C[NH2+]CCC1=NC2=CC=CC=C2N1CC(=O)[O-]

InChI

InChI=1S/C12H15N3O2/c1-13-7-6-11-14-9-4-2-3-5-10(9)15(11)8-12(16)17/h2-5,13H,6-8H2,1H3,(H,16,17)