2-[(2S,3S)-3-methyl-4-oxidanyl-4-oxidanylidene-butan-2-yl]pyridine-3-carboxylic acid

Systemtic Name: 2-[(2S,3S)-3-methyl-4-oxidanyl-4-oxidanylidene-butan-2-yl]pyridine-3-carboxylic acid Openeye Name: 2-[(1S,2S)-3-hydroxy-1,2-dimethyl-3-oxo-propyl]pyridine-3-carboxylic acid CAS Name: 2-[(2S,3S)-4-hydroxy-3-methyl-4-oxobutan-2-yl]-3-pyridinecarboxylic acid IUPAC Name: 2-[(2S,3S)-4-hydroxy-3-methyl-4-oxobutan-2-yl]pyridine-3-carboxylic acid Traditional Name: 2-[(1S,2S)-3-hydroxy-3-keto-1,2-dimethyl-propyl]nicotinic acid Formula: C11H13NO4 MolecularWeight: 223.22522

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=CC=N1)C(=O)O)C(C)C(=O)O

Isomeric SMILES

C[C@H](C1=C(C=CC=N1)C(=O)O)[C@H](C)C(=O)O

InChI

InChI=1S/C11H13NO4/c1-6(7(2)10(13)14)9-8(11(15)16)4-3-5-12-9/h3-7H,1-2H3,(H,13,14)(H,15,16)/t6-,7-/m0/s1