1-(3-methylbutyl)-6-oxidanylidene-pyridine-3-carboxylic acid

Systemtic Name: 1-(3-methylbutyl)-6-oxidanylidene-pyridine-3-carboxylic acid Openeye Name: 1-isopentyl-6-oxo-pyridine-3-carboxylic acid CAS Name: 1-(3-methylbutyl)-6-oxo-3-pyridinecarboxylic acid IUPAC Name: 1-(3-methylbutyl)-6-oxopyridine-3-carboxylic acid Traditional Name: 1-isoamyl-6-keto-nicotinic acid Formula: C11H15NO3 MolecularWeight: 209.2417

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C=C(C=CC1=O)C(=O)O

Isomeric SMILES

CC(C)CCN1C=C(C=CC1=O)C(=O)O

InChI

InChI=1S/C11H15NO3/c1-8(2)5-6-12-7-9(11(14)15)3-4-10(12)13/h3-4,7-8H,5-6H2,1-2H3,(H,14,15)