5-ethoxycarbonyl-6-oxidanylidene-1H-pyridine-3-sulfonic acid

Systemtic Name: 5-ethoxycarbonyl-6-oxidanylidene-1H-pyridine-3-sulfonic acid Openeye Name: 5-ethoxycarbonyl-6-oxo-1H-pyridine-3-sulfonic acid CAS Name: 5-ethoxycarbonyl-6-oxo-1H-pyridine-3-sulfonic acid IUPAC Name: 5-ethoxycarbonyl-6-oxo-1H-pyridine-3-sulfonic acid Traditional Name: 5-carbethoxy-6-keto-1H-pyridine-3-sulfonic acid Formula: C8H9NO6S MolecularWeight: 247.22516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CNC1=O)S(=O)(=O)O

Isomeric SMILES

CCOC(=O)C1=CC(=CNC1=O)S(=O)(=O)O

InChI

InChI=1S/C8H9NO6S/c1-2-15-8(11)6-3-5(16(12,13)14)4-9-7(6)10/h3-4H,2H2,1H3,(H,9,10)(H,12,13,14)