1-methoxycarbonyl-4-(2-methyl-1-oxidanyl-1-oxidanylidene-propan-2-yl)-4H-pyridine-3-carboxylic acid

Systemtic Name: 1-methoxycarbonyl-4-(2-methyl-1-oxidanyl-1-oxidanylidene-propan-2-yl)-4H-pyridine-3-carboxylic acid Openeye Name: 4-(2-hydroxy-1,1-dimethyl-2-oxo-ethyl)-1-methoxycarbonyl-4H-pyridine-3-carboxylic acid CAS Name: 4-(1-hydroxy-2-methyl-1-oxopropan-2-yl)-1-methoxycarbonyl-4H-pyridine-3-carboxylic acid IUPAC Name: 4-(1-hydroxy-2-methyl-1-oxopropan-2-yl)-1-methoxycarbonyl-4H-pyridine-3-carboxylic acid Traditional Name: 1-carbomethoxy-4-(2-hydroxy-2-keto-1,1-dimethyl-ethyl)-4H-pyridine-3-carboxylic acid Formula: C12H15NO6 MolecularWeight: 269.2506

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1C=CN(C=C1C(=O)O)C(=O)OC)C(=O)O

Isomeric SMILES

CC(C)(C1C=CN(C=C1C(=O)O)C(=O)OC)C(=O)O

InChI

InChI=1S/C12H15NO6/c1-12(2,10(16)17)8-4-5-13(11(18)19-3)6-7(8)9(14)15/h4-6,8H,1-3H3,(H,14,15)(H,16,17)