5-ethoxy-1-ethyl-benzimidazole-2-sulfonate

Systemtic Name: 5-ethoxy-1-ethyl-benzimidazole-2-sulfonate Openeye Name: 5-ethoxy-1-ethyl-benzimidazole-2-sulfonate CAS Name: 5-ethoxy-1-ethyl-2-benzimidazolesulfonate IUPAC Name: 5-ethoxy-1-ethylbenzimidazole-2-sulfonate Traditional Name: 5-ethoxy-1-ethyl-benzimidazole-2-sulfonate Formula: C11H13N2O4S- MolecularWeight: 269.29692

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)OCC)N=C1S(=O)(=O)[O-]

Isomeric SMILES

CCN1C2=C(C=C(C=C2)OCC)N=C1S(=O)(=O)[O-]

InChI

InChI=1S/C11H14N2O4S/c1-3-13-10-6-5-8(17-4-2)7-9(10)12-11(13)18(14,15)16/h5-7H,3-4H2,1-2H3,(H,14,15,16)/p-1