sodium 1,2-dimethyl-4-oxidanylidene-5-phenyl-pyridine-3-carboxylic acid

Systemtic Name: sodium 1,2-dimethyl-4-oxidanylidene-5-phenyl-pyridine-3-carboxylic acid Openeye Name: sodium 1,2-dimethyl-4-oxo-5-phenyl-pyridine-3-carboxylic acid CAS Name: sodium 1,2-dimethyl-4-oxo-5-phenyl-3-pyridinecarboxylic acid IUPAC Name: sodium 1,2-dimethyl-4-oxo-5-phenylpyridine-3-carboxylic acid Traditional Name: sodium 4-keto-1,2-dimethyl-5-phenyl-nicotinic acid Formula: C14H13NNaO3+ MolecularWeight: 266.24769

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C(=CN1C)C2=CC=CC=C2)C(=O)O.[Na+]

Isomeric SMILES

CC1=C(C(=O)C(=CN1C)C2=CC=CC=C2)C(=O)O.[Na+]

InChI

InChI=1S/C14H13NO3.Na/c1-9-12(14(17)18)13(16)11(8-15(9)2)10-6-4-3-5-7-10;/h3-8H,1-2H3,(H,17,18);/q;+1