1-butyl-4-oxidanylidene-6-phenyl-pyridine-3-carboxylic acid

Systemtic Name: 1-butyl-4-oxidanylidene-6-phenyl-pyridine-3-carboxylic acid Openeye Name: 1-butyl-4-oxo-6-phenyl-pyridine-3-carboxylic acid CAS Name: 1-butyl-4-oxo-6-phenyl-3-pyridinecarboxylic acid IUPAC Name: 1-butyl-4-oxo-6-phenylpyridine-3-carboxylic acid Traditional Name: 1-butyl-4-keto-6-phenyl-nicotinic acid Formula: C16H17NO3 MolecularWeight: 271.31108

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=C(C(=O)C=C1C2=CC=CC=C2)C(=O)O

Isomeric SMILES

CCCCN1C=C(C(=O)C=C1C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C16H17NO3/c1-2-3-9-17-11-13(16(19)20)15(18)10-14(17)12-7-5-4-6-8-12/h4-8,10-11H,2-3,9H2,1H3,(H,19,20)