3-methylbenzenesulfonate

Systemtic Name: 3-methylbenzenesulfonate Openeye Name: 3-methylbenzenesulfonate CAS Name: 3-methylbenzenesulfonate IUPAC Name: 3-methylbenzenesulfonate Traditional Name: 3-methylbesylate Formula: C7H7O3S- MolecularWeight: 171.19368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)S(=O)(=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)S(=O)(=O)[O-]

InChI

InChI=1S/C7H8O3S/c1-6-3-2-4-7(5-6)11(8,9)10/h2-5H,1H3,(H,8,9,10)/p-1