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

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

Systemtic Name:4-[2-(1H-imidazol-3-ium-3-yl)ethoxy]benzoic acid chloride
Openeye Name:4-[2-(1H-imidazol-3-ium-3-yl)ethoxy]benzoic acid chloride
CAS Name:4-[2-(1H-imidazol-3-ium-3-yl)ethoxy]benzoic acid chloride
IUPAC Name:4-[2-(1H-imidazol-3-ium-3-yl)ethoxy]benzoic acid chloride
Traditional Name:4-[2-(1H-imidazol-3-ium-3-yl)ethoxy]benzoic acid chloride
Formula: C12H13ClN2O3
MolecularWeight: 268.69622
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C12H12N2O3.ClH/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);1H


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