1-[1,4-bis(oxidanyl)imidazol-2-yl]carbothioyloxy-2-oxidanylidene-cyclohexane-1-carboxylate

Systemtic Name: 1-[1,4-bis(oxidanyl)imidazol-2-yl]carbothioyloxy-2-oxidanylidene-cyclohexane-1-carboxylate Openeye Name: 1-(1,4-dihydroxyimidazole-2-carbothioyl)oxy-2-oxo-cyclohexanecarboxylate CAS Name: 1-[(1,4-dihydroxy-2-imidazolyl)-sulfanylidenemethoxy]-2-oxo-1-cyclohexanecarboxylate IUPAC Name: 1-(1,4-dihydroxyimidazole-2-carbothioyl)oxy-2-oxocyclohexane-1-carboxylate Traditional Name: 1-(1,4-dihydroxyimidazole-2-carbothioyl)oxy-2-keto-cyclohexanecarboxylate Formula: C11H11N2O6S- MolecularWeight: 299.27984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(=O)C1)(C(=O)[O-])OC(=S)C2=NC(=CN2O)O

Isomeric SMILES

C1CCC(C(=O)C1)(C(=O)[O-])OC(=S)C2=NC(=CN2O)O

InChI

InChI=1S/C11H12N2O6S/c14-6-3-1-2-4-11(6,10(16)17)19-9(20)8-12-7(15)5-13(8)18/h5,15,18H,1-4H2,(H,16,17)/p-1