1-[(3-chlorophenyl)methyl]-6-oxidanylidene-pyridine-3-carboxylic acid

Systemtic Name: 1-[(3-chlorophenyl)methyl]-6-oxidanylidene-pyridine-3-carboxylic acid Openeye Name: 1-[(3-chlorophenyl)methyl]-6-oxo-pyridine-3-carboxylic acid CAS Name: 1-[(3-chlorophenyl)methyl]-6-oxo-3-pyridinecarboxylic acid IUPAC Name: 1-[(3-chlorophenyl)methyl]-6-oxopyridine-3-carboxylic acid Traditional Name: 1-(3-chlorobenzyl)-6-keto-nicotinic acid Formula: C13H10ClNO3 MolecularWeight: 263.6764

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)CN2C=C(C=CC2=O)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)Cl)CN2C=C(C=CC2=O)C(=O)O

InChI

InChI=1S/C13H10ClNO3/c14-11-3-1-2-9(6-11)7-15-8-10(13(17)18)4-5-12(15)16/h1-6,8H,7H2,(H,17,18)