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

Systemtic Name: 6-butyl-1-methyl-2-(4-methylphenyl)-4-oxidanylidene-pyridine-3-carboxylic acid Openeye Name: 6-butyl-1-methyl-4-oxo-2-(p-tolyl)pyridine-3-carboxylic acid CAS Name: 6-butyl-1-methyl-2-(4-methylphenyl)-4-oxo-3-pyridinecarboxylic acid IUPAC Name: 6-butyl-1-methyl-2-(4-methylphenyl)-4-oxopyridine-3-carboxylic acid Traditional Name: 6-butyl-4-keto-1-methyl-2-(p-tolyl)nicotinic acid Formula: C18H21NO3 MolecularWeight: 299.36424

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)C(=C(N1C)C2=CC=C(C=C2)C)C(=O)O

Isomeric SMILES

CCCCC1=CC(=O)C(=C(N1C)C2=CC=C(C=C2)C)C(=O)O

InChI

InChI=1S/C18H21NO3/c1-4-5-6-14-11-15(20)16(18(21)22)17(19(14)3)13-9-7-12(2)8-10-13/h7-11H,4-6H2,1-3H3,(H,21,22)