5-(1-ethyl-3-methylsulfonyl-2-oxidanyl-6-oxidanylidene-pyridin-4-yl)-2-methoxy-benzenesulfonic acid

Systemtic Name: 5-(1-ethyl-3-methylsulfonyl-2-oxidanyl-6-oxidanylidene-pyridin-4-yl)-2-methoxy-benzenesulfonic acid Openeye Name: 5-(1-ethyl-2-hydroxy-3-methylsulfonyl-6-oxo-4-pyridyl)-2-methoxy-benzenesulfonic acid CAS Name: 5-(1-ethyl-2-hydroxy-3-methylsulfonyl-6-oxo-4-pyridinyl)-2-methoxybenzenesulfonic acid IUPAC Name: 5-(1-ethyl-2-hydroxy-3-methylsulfonyl-6-oxopyridin-4-yl)-2-methoxybenzenesulfonic acid Traditional Name: 5-(1-ethyl-2-hydroxy-6-keto-3-mesyl-4-pyridyl)-2-methoxy-besylic acid Formula: C15H17NO8S2 MolecularWeight: 403.42738

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C=C(C(=C1O)S(=O)(=O)C)C2=CC(=C(C=C2)OC)S(=O)(=O)O

Isomeric SMILES

CCN1C(=O)C=C(C(=C1O)S(=O)(=O)C)C2=CC(=C(C=C2)OC)S(=O)(=O)O

InChI

InChI=1S/C15H17NO8S2/c1-4-16-13(17)8-10(14(15(16)18)25(3,19)20)9-5-6-11(24-2)12(7-9)26(21,22)23/h5-8,18H,4H2,1-3H3,(H,21,22,23)