1-(3-chloranylpropyl)-2-methyl-4-oxidanylidene-6-phenyl-pyridine-3-carboxylic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C=C(N1CCCCl)C2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC1=C(C(=O)C=C(N1CCCCl)C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C16H16ClNO3/c1-11-15(16(20)21)14(19)10-13(18(11)9-5-8-17)12-6-3-2-4-7-12/h2-4,6-7,10H,5,8-9H2,1H3,(H,20,21)