3-[[2-[4,5-bis(oxidanyl)-3-oxidanylidene-furan-2-yl]-2-oxidanyl-ethoxy]carbonylamino]propane-1-sulfonic acid

Systemtic Name: 3-[[2-[4,5-bis(oxidanyl)-3-oxidanylidene-furan-2-yl]-2-oxidanyl-ethoxy]carbonylamino]propane-1-sulfonic acid Openeye Name: 3-[[2-(4,5-dihydroxy-3-oxo-2-furyl)-2-hydroxy-ethoxy]carbonylamino]propane-1-sulfonic acid CAS Name: 3-[[[2-(4,5-dihydroxy-3-oxo-2-furanyl)-2-hydroxyethoxy]-oxomethyl]amino]-1-propanesulfonic acid IUPAC Name: 3-[[2-(4,5-dihydroxy-3-oxofuran-2-yl)-2-hydroxyethoxy]carbonylamino]propane-1-sulfonic acid Traditional Name: 3-[[2-(4,5-dihydroxy-3-keto-2-furyl)-2-hydroxy-ethoxy]carbonylamino]propane-1-sulfonic acid Formula: C10H15NO10S MolecularWeight: 341.2918

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Descriptors Computed from Structure

Canonical SMILES:

C(CNC(=O)OCC(C1C(=O)C(=C(O1)O)O)O)CS(=O)(=O)O

Isomeric SMILES

C(CNC(=O)OCC(C1C(=O)C(=C(O1)O)O)O)CS(=O)(=O)O

InChI

InChI=1S/C10H15NO10S/c12-5(8-6(13)7(14)9(15)21-8)4-20-10(16)11-2-1-3-22(17,18)19/h5,8,12,14-15H,1-4H2,(H,11,16)(H,17,18,19)