4-oxidanylidene-1-(4-sulfophenyl)pyridine-2-carboxylic acid

Systemtic Name: 4-oxidanylidene-1-(4-sulfophenyl)pyridine-2-carboxylic acid Openeye Name: 4-oxo-1-(4-sulfophenyl)pyridine-2-carboxylic acid CAS Name: 4-oxo-1-(4-sulfophenyl)-2-pyridinecarboxylic acid IUPAC Name: 4-oxo-1-(4-sulfophenyl)pyridine-2-carboxylic acid Traditional Name: 4-keto-1-(4-sulfophenyl)picolinic acid Formula: C12H9NO6S MolecularWeight: 295.26796

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C=CC(=O)C=C2C(=O)O)S(=O)(=O)O

Isomeric SMILES

C1=CC(=CC=C1N2C=CC(=O)C=C2C(=O)O)S(=O)(=O)O

InChI

InChI=1S/C12H9NO6S/c14-9-5-6-13(11(7-9)12(15)16)8-1-3-10(4-2-8)20(17,18)19/h1-7H,(H,15,16)(H,17,18,19)