3-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-4-oxidanyl-5-oxidanylidene-2-pyridin-2-ylsulfanylcarbonyl-furan-2-carboxylic acid

Systemtic Name: 3-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-4-oxidanyl-5-oxidanylidene-2-pyridin-2-ylsulfanylcarbonyl-furan-2-carboxylic acid Openeye Name: 4-hydroxy-3-(1-oxidopyridin-1-ium-2-yl)sulfanyl-5-oxo-2-(2-pyridylsulfanylcarbonyl)furan-2-carboxylic acid CAS Name: 4-hydroxy-3-[(1-oxido-2-pyridin-1-iumyl)thio]-5-oxo-2-[oxo-(2-pyridinylthio)methyl]-2-furancarboxylic acid IUPAC Name: 4-hydroxy-3-(1-oxidopyridin-1-ium-2-yl)sulfanyl-5-oxo-2-pyridin-2-ylsulfanylcarbonylfuran-2-carboxylic acid Traditional Name: 4-hydroxy-5-keto-3-[(1-oxidopyridin-1-ium-2-yl)thio]-2-(2-pyridylthio)carbonyl-2-furoic acid Formula: C16H10N2O7S2 MolecularWeight: 406.3898

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)SC(=O)C2(C(=C(C(=O)O2)O)SC3=CC=CC=[N+]3[O-])C(=O)O

Isomeric SMILES

C1=CC=NC(=C1)SC(=O)C2(C(=C(C(=O)O2)O)SC3=CC=CC=[N+]3[O-])C(=O)O

InChI

InChI=1S/C16H10N2O7S2/c19-11-12(27-10-6-2-4-8-18(10)24)16(14(21)22,25-13(11)20)15(23)26-9-5-1-3-7-17-9/h1-8,19H,(H,21,22)