(3-chloranyl-2-oxidanyl-6-oxidanylidene-1-propan-2-yl-pyridin-4-yl)methanesulfonic acid

Systemtic Name: (3-chloranyl-2-oxidanyl-6-oxidanylidene-1-propan-2-yl-pyridin-4-yl)methanesulfonic acid Openeye Name: (3-chloro-2-hydroxy-1-isopropyl-6-oxo-4-pyridyl)methanesulfonic acid CAS Name: (3-chloro-2-hydroxy-6-oxo-1-propan-2-yl-4-pyridinyl)methanesulfonic acid IUPAC Name: (3-chloro-2-hydroxy-6-oxo-1-propan-2-ylpyridin-4-yl)methanesulfonic acid Traditional Name: (3-chloro-2-hydroxy-1-isopropyl-6-keto-4-pyridyl)methanesulfonic acid Formula: C9H12ClNO5S MolecularWeight: 281.71328

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C=C(C(=C1O)Cl)CS(=O)(=O)O

Isomeric SMILES

CC(C)N1C(=O)C=C(C(=C1O)Cl)CS(=O)(=O)O

InChI

InChI=1S/C9H12ClNO5S/c1-5(2)11-7(12)3-6(4-17(14,15)16)8(10)9(11)13/h3,5,13H,4H2,1-2H3,(H,14,15,16)