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

Systemtic Name: 2-(3-chlorophenyl)-1-hexyl-6-methyl-4-oxidanylidene-pyridine-3-carboxylic acid Openeye Name: 2-(3-chlorophenyl)-1-hexyl-6-methyl-4-oxo-pyridine-3-carboxylic acid CAS Name: 2-(3-chlorophenyl)-1-hexyl-6-methyl-4-oxo-3-pyridinecarboxylic acid IUPAC Name: 2-(3-chlorophenyl)-1-hexyl-6-methyl-4-oxopyridine-3-carboxylic acid Traditional Name: 2-(3-chlorophenyl)-1-hexyl-4-keto-6-methyl-nicotinic acid Formula: C19H22ClNO3 MolecularWeight: 347.83588

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=CC(=O)C(=C1C2=CC(=CC=C2)Cl)C(=O)O)C

Isomeric SMILES

CCCCCCN1C(=CC(=O)C(=C1C2=CC(=CC=C2)Cl)C(=O)O)C

InChI

InChI=1S/C19H22ClNO3/c1-3-4-5-6-10-21-13(2)11-16(22)17(19(23)24)18(21)14-8-7-9-15(20)12-14/h7-9,11-12H,3-6,10H2,1-2H3,(H,23,24)