5-(4-chlorophenyl)-2-methyl-4-oxidanylidene-1-propan-2-yl-pyridine-3-carboxylic acid

Systemtic Name: 5-(4-chlorophenyl)-2-methyl-4-oxidanylidene-1-propan-2-yl-pyridine-3-carboxylic acid Openeye Name: 5-(4-chlorophenyl)-1-isopropyl-2-methyl-4-oxo-pyridine-3-carboxylic acid CAS Name: 5-(4-chlorophenyl)-2-methyl-4-oxo-1-propan-2-yl-3-pyridinecarboxylic acid IUPAC Name: 5-(4-chlorophenyl)-2-methyl-4-oxo-1-propan-2-ylpyridine-3-carboxylic acid Traditional Name: 5-(4-chlorophenyl)-1-isopropyl-4-keto-2-methyl-nicotinic acid Formula: C16H16ClNO3 MolecularWeight: 305.75614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C(=CN1C(C)C)C2=CC=C(C=C2)Cl)C(=O)O

Isomeric SMILES

CC1=C(C(=O)C(=CN1C(C)C)C2=CC=C(C=C2)Cl)C(=O)O

InChI

InChI=1S/C16H16ClNO3/c1-9(2)18-8-13(11-4-6-12(17)7-5-11)15(19)14(10(18)3)16(20)21/h4-9H,1-3H3,(H,20,21)