1-butyl-2-(4-chlorophenyl)-6-methyl-4-oxidanylidene-pyridine-3-carboxylic acid

Systemtic Name: 1-butyl-2-(4-chlorophenyl)-6-methyl-4-oxidanylidene-pyridine-3-carboxylic acid Openeye Name: 1-butyl-2-(4-chlorophenyl)-6-methyl-4-oxo-pyridine-3-carboxylic acid CAS Name: 1-butyl-2-(4-chlorophenyl)-6-methyl-4-oxo-3-pyridinecarboxylic acid IUPAC Name: 1-butyl-2-(4-chlorophenyl)-6-methyl-4-oxopyridine-3-carboxylic acid Traditional Name: 1-butyl-2-(4-chlorophenyl)-4-keto-6-methyl-nicotinic acid Formula: C17H18ClNO3 MolecularWeight: 319.78272

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18ClNO3/c1-3-4-9-19-11(2)10-14(20)15(17(21)22)16(19)12-5-7-13(18)8-6-12/h5-8,10H,3-4,9H2,1-2H3,(H,21,22)