1-butyl-5-iodanyl-2-oxidanylidene-pyridine-3-carboxylic acid

Systemtic Name: 1-butyl-5-iodanyl-2-oxidanylidene-pyridine-3-carboxylic acid Openeye Name: 1-butyl-5-iodo-2-oxo-pyridine-3-carboxylic acid CAS Name: 1-butyl-5-iodo-2-oxo-3-pyridinecarboxylic acid IUPAC Name: 1-butyl-5-iodo-2-oxopyridine-3-carboxylic acid Traditional Name: 1-butyl-5-iodo-2-keto-nicotinic acid Formula: C10H12INO3 MolecularWeight: 321.11165

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=C(C=C(C1=O)C(=O)O)I

Isomeric SMILES

CCCCN1C=C(C=C(C1=O)C(=O)O)I

InChI

InChI=1S/C10H12INO3/c1-2-3-4-12-6-7(11)5-8(9(12)13)10(14)15/h5-6H,2-4H2,1H3,(H,14,15)