sodium 3-(phenylsulfonyl)benzenesulfonate

Systemtic Name: sodium 3-(phenylsulfonyl)benzenesulfonate Openeye Name: sodium 3-(benzenesulfonyl)benzenesulfonate CAS Name: sodium 3-(benzenesulfonyl)benzenesulfonate IUPAC Name: sodium 3-(benzenesulfonyl)benzenesulfonate Traditional Name: sodium 3-besylbesylate Formula: C12H9NaO5S2 MolecularWeight: 320.31663

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)C2=CC(=CC=C2)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)C2=CC(=CC=C2)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C12H10O5S2.Na/c13-18(14,10-5-2-1-3-6-10)11-7-4-8-12(9-11)19(15,16)17;/h1-9H,(H,15,16,17);/q;+1/p-1