1-(3-acetamidopropyl)-4-methyl-2-oxidanyl-6-oxidanylidene-pyridine-3-sulfonic acid

Systemtic Name: 1-(3-acetamidopropyl)-4-methyl-2-oxidanyl-6-oxidanylidene-pyridine-3-sulfonic acid Openeye Name: 1-(3-acetamidopropyl)-2-hydroxy-4-methyl-6-oxo-pyridine-3-sulfonic acid CAS Name: 1-(3-acetamidopropyl)-2-hydroxy-4-methyl-6-oxo-3-pyridinesulfonic acid IUPAC Name: 1-(3-acetamidopropyl)-2-hydroxy-4-methyl-6-oxopyridine-3-sulfonic acid Traditional Name: 1-(3-acetamidopropyl)-2-hydroxy-6-keto-4-methyl-pyridine-3-sulfonic acid Formula: C11H16N2O6S MolecularWeight: 304.31954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C(=C1S(=O)(=O)O)O)CCCNC(=O)C

Isomeric SMILES

CC1=CC(=O)N(C(=C1S(=O)(=O)O)O)CCCNC(=O)C

InChI

InChI=1S/C11H16N2O6S/c1-7-6-9(15)13(5-3-4-12-8(2)14)11(16)10(7)20(17,18)19/h6,16H,3-5H2,1-2H3,(H,12,14)(H,17,18,19)