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

Systemtic Name: 6-(4-chlorophenyl)-1-methyl-4-oxidanylidene-2-propyl-pyridine-3-carboxylic acid Openeye Name: 6-(4-chlorophenyl)-1-methyl-4-oxo-2-propyl-pyridine-3-carboxylic acid CAS Name: 6-(4-chlorophenyl)-1-methyl-4-oxo-2-propyl-3-pyridinecarboxylic acid IUPAC Name: 6-(4-chlorophenyl)-1-methyl-4-oxo-2-propylpyridine-3-carboxylic acid Traditional Name: 6-(4-chlorophenyl)-4-keto-1-methyl-2-propyl-nicotinic acid Formula: C16H16ClNO3 MolecularWeight: 305.75614

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=O)C=C(N1C)C2=CC=C(C=C2)Cl)C(=O)O

Isomeric SMILES

CCCC1=C(C(=O)C=C(N1C)C2=CC=C(C=C2)Cl)C(=O)O

InChI

InChI=1S/C16H16ClNO3/c1-3-4-12-15(16(20)21)14(19)9-13(18(12)2)10-5-7-11(17)8-6-10/h5-9H,3-4H2,1-2H3,(H,20,21)