1-(2-methylpropyl)-2-oxidanylidene-pyridine-3-carboxylic acid

Systemtic Name: 1-(2-methylpropyl)-2-oxidanylidene-pyridine-3-carboxylic acid Openeye Name: 1-isobutyl-2-oxo-pyridine-3-carboxylic acid CAS Name: 1-(2-methylpropyl)-2-oxo-3-pyridinecarboxylic acid IUPAC Name: 1-(2-methylpropyl)-2-oxopyridine-3-carboxylic acid Traditional Name: 1-isobutyl-2-keto-nicotinic acid Formula: C10H13NO3 MolecularWeight: 195.21512

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C=CC=C(C1=O)C(=O)O

Isomeric SMILES

CC(C)CN1C=CC=C(C1=O)C(=O)O

InChI

InChI=1S/C10H13NO3/c1-7(2)6-11-5-3-4-8(9(11)12)10(13)14/h3-5,7H,6H2,1-2H3,(H,13,14)