3-(4-methylphenyl)sulfonylbenzenesulfonic acid

Systemtic Name: 3-(4-methylphenyl)sulfonylbenzenesulfonic acid Openeye Name: 3-(p-tolylsulfonyl)benzenesulfonic acid CAS Name: 3-(4-methylphenyl)sulfonylbenzenesulfonic acid IUPAC Name: 3-(4-methylphenyl)sulfonylbenzenesulfonic acid Traditional Name: 3-tosylbesylic acid Formula: C13H12O5S2 MolecularWeight: 312.36138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=CC(=CC=C2)S(=O)(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=CC(=CC=C2)S(=O)(=O)O

InChI

InChI=1S/C13H12O5S2/c1-10-5-7-11(8-6-10)19(14,15)12-3-2-4-13(9-12)20(16,17)18/h2-9H,1H3,(H,16,17,18)