4-[2-(1H-imidazol-3-ium-3-yl)ethoxy]benzoic acid

Systemtic Name: 4-[2-(1H-imidazol-3-ium-3-yl)ethoxy]benzoic acid Openeye Name: 4-[2-(1H-imidazol-3-ium-3-yl)ethoxy]benzoic acid CAS Name: 4-[2-(1H-imidazol-3-ium-3-yl)ethoxy]benzoic acid IUPAC Name: 4-[2-(1H-imidazol-3-ium-3-yl)ethoxy]benzoic acid Traditional Name: 4-[2-(1H-imidazol-3-ium-3-yl)ethoxy]benzoic acid Formula: C12H13N2O3+ MolecularWeight: 233.24322

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)OCC[N+]2=CNC=C2

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)OCC[N+]2=CNC=C2

InChI

InChI=1S/C12H12N2O3/c15-12(16)10-1-3-11(4-2-10)17-8-7-14-6-5-13-9-14/h1-6,9H,7-8H2,(H,15,16)/p+1