2-(4-carboxypyridin-1-ium-1-yl)pyridine-4-carboxylic acid

Systemtic Name: 2-(4-carboxypyridin-1-ium-1-yl)pyridine-4-carboxylic acid Openeye Name: 2-(4-carboxypyridin-1-ium-1-yl)pyridine-4-carboxylic acid CAS Name: 2-(4-carboxy-1-pyridin-1-iumyl)-4-pyridinecarboxylic acid IUPAC Name: 2-(4-carboxypyridin-1-ium-1-yl)pyridine-4-carboxylic acid Traditional Name: 2-(4-carboxypyridin-1-ium-1-yl)isonicotinic acid Formula: C12H9N2O4+ MolecularWeight: 245.21086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(C=C1C(=O)O)[N+]2=CC=C(C=C2)C(=O)O

Isomeric SMILES

C1=CN=C(C=C1C(=O)O)[N+]2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C12H8N2O4/c15-11(16)8-2-5-14(6-3-8)10-7-9(12(17)18)1-4-13-10/h1-7H,(H-,15,16,17,18)/p+1