sodium 3-carboxybenzenesulfonate

Systemtic Name: sodium 3-carboxybenzenesulfonate Openeye Name: sodium 3-carboxybenzenesulfonate CAS Name: sodium 3-carboxybenzenesulfonate IUPAC Name: sodium 3-carboxybenzenesulfonate Traditional Name: sodium 3-carboxybesylate Formula: C7H5NaO5S MolecularWeight: 224.16637

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)[O-])C(=O)O.[Na+]

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)[O-])C(=O)O.[Na+]

InChI

InChI=1S/C7H6O5S.Na/c8-7(9)5-2-1-3-6(4-5)13(10,11)12;/h1-4H,(H,8,9)(H,10,11,12);/q;+1/p-1