2-[3-(pyridin-2-ylmethyl)imidazol-3-ium-1-yl]ethanoic acid

Systemtic Name: 2-[3-(pyridin-2-ylmethyl)imidazol-3-ium-1-yl]ethanoic acid Openeye Name: 2-[3-(2-pyridylmethyl)imidazol-3-ium-1-yl]acetic acid CAS Name: 2-[3-(2-pyridinylmethyl)-1-imidazol-3-iumyl]acetic acid IUPAC Name: 2-[3-(pyridin-2-ylmethyl)imidazol-3-ium-1-yl]acetic acid Traditional Name: 2-[3-(2-pyridylmethyl)imidazol-3-ium-1-yl]acetic acid Formula: C11H12N3O2+ MolecularWeight: 218.23188

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C[N+]2=CN(C=C2)CC(=O)O

Isomeric SMILES

C1=CC=NC(=C1)C[N+]2=CN(C=C2)CC(=O)O

InChI

InChI=1S/C11H11N3O2/c15-11(16)8-14-6-5-13(9-14)7-10-3-1-2-4-12-10/h1-6,9H,7-8H2/p+1