2-[3-(1H-imidazol-5-ylmethoxy)phenoxy]-2-oxidanylidene-ethanoate; methanesulfonamide

Systemtic Name: 2-[3-(1H-imidazol-5-ylmethoxy)phenoxy]-2-oxidanylidene-ethanoate; methanesulfonamide Openeye Name: 2-[3-(1H-imidazol-5-ylmethoxy)phenoxy]-2-oxo-acetate; methanesulfonamide CAS Name: 2-[3-(1H-imidazol-5-ylmethoxy)phenoxy]-2-oxoacetate; methanesulfonamide IUPAC Name: 2-[3-(1H-imidazol-5-ylmethoxy)phenoxy]-2-oxoacetate; methanesulfonamide Traditional Name: 2-[3-(1H-imidazol-5-ylmethoxy)phenoxy]-2-keto-acetate; methanesulfonamide Formula: C13H14N3O7S- MolecularWeight: 356.33116

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N.C1=CC(=CC(=C1)OCC2=CN=CN2)OC(=O)C(=O)[O-]

Isomeric SMILES

CS(=O)(=O)N.C1=CC(=CC(=C1)OCC2=CN=CN2)OC(=O)C(=O)[O-]

InChI

InChI=1S/C12H10N2O5.CH5NO2S/c15-11(16)12(17)19-10-3-1-2-9(4-10)18-6-8-5-13-7-14-8;1-5(2,3)4/h1-5,7H,6H2,(H,13,14)(H,15,16);1H3,(H2,2,3,4)/p-1