disodium 2-(4-sulfonatophenyl)ethanoate

Systemtic Name: disodium 2-(4-sulfonatophenyl)ethanoate Openeye Name: disodium 2-(4-sulfonatophenyl)acetate CAS Name: disodium 2-(4-sulfonatophenyl)acetate IUPAC Name: disodium 2-(4-sulfonatophenyl)acetate Traditional Name: disodium 2-(4-sulfonatophenyl)acetate Formula: C8H6Na2O5S MolecularWeight: 260.17478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]

Isomeric SMILES

C1=CC(=CC=C1CC(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C8H8O5S.2Na/c9-8(10)5-6-1-3-7(4-2-6)14(11,12)13;;/h1-4H,5H2,(H,9,10)(H,11,12,13);;/q;2*+1/p-2