sodium 4-[2-(1H-imidazol-1-ium-1-yl)ethoxycarbonyloxy]benzenesulfonic acid chloride

Systemtic Name: sodium 4-[2-(1H-imidazol-1-ium-1-yl)ethoxycarbonyloxy]benzenesulfonic acid chloride Openeye Name: sodium 4-[2-(1H-imidazol-1-ium-1-yl)ethoxycarbonyloxy]benzenesulfonic acid chloride CAS Name: sodium 4-[2-(1H-imidazol-1-ium-1-yl)ethoxy-oxomethoxy]benzenesulfonic acid chloride IUPAC Name: sodium 4-[2-(1H-imidazol-1-ium-1-yl)ethoxycarbonyloxy]benzenesulfonic acid chloride Traditional Name: sodium 4-[2-(1H-imidazol-1-ium-1-yl)ethoxycarbonyloxy]besylic acid chloride Formula: C12H13ClN2NaO6S+ MolecularWeight: 371.74919

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OC(=O)OCC[NH+]2C=CN=C2)S(=O)(=O)O.[Na+].[Cl-]

Isomeric SMILES

C1=CC(=CC=C1OC(=O)OCC[NH+]2C=CN=C2)S(=O)(=O)O.[Na+].[Cl-]

InChI

InChI=1S/C12H12N2O6S.ClH.Na/c15-12(19-8-7-14-6-5-13-9-14)20-10-1-3-11(4-2-10)21(16,17)18;;/h1-6,9H,7-8H2,(H,16,17,18);1H;/q;;+1