1-(4-methyl-2-oxidanyl-6-oxidanylidene-1-propan-2-yl-pyridin-3-yl)ethanesulfonic acid

Systemtic Name: 1-(4-methyl-2-oxidanyl-6-oxidanylidene-1-propan-2-yl-pyridin-3-yl)ethanesulfonic acid Openeye Name: 1-(2-hydroxy-1-isopropyl-4-methyl-6-oxo-3-pyridyl)ethanesulfonic acid CAS Name: 1-(2-hydroxy-4-methyl-6-oxo-1-propan-2-yl-3-pyridinyl)ethanesulfonic acid IUPAC Name: 1-(2-hydroxy-4-methyl-6-oxo-1-propan-2-ylpyridin-3-yl)ethanesulfonic acid Traditional Name: 1-(2-hydroxy-1-isopropyl-6-keto-4-methyl-3-pyridyl)ethanesulfonic acid Formula: C11H17NO5S MolecularWeight: 275.32138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C(=C1C(C)S(=O)(=O)O)O)C(C)C

Isomeric SMILES

CC1=CC(=O)N(C(=C1C(C)S(=O)(=O)O)O)C(C)C

InChI

InChI=1S/C11H17NO5S/c1-6(2)12-9(13)5-7(3)10(11(12)14)8(4)18(15,16)17/h5-6,8,14H,1-4H3,(H,15,16,17)