4-methyl-2-sulfanyl-benzenesulfonic acid

Systemtic Name: 4-methyl-2-sulfanyl-benzenesulfonic acid Openeye Name: 4-methyl-2-sulfanyl-benzenesulfonic acid CAS Name: 2-mercapto-4-methylbenzenesulfonic acid IUPAC Name: 4-methyl-2-sulfanylbenzenesulfonic acid Traditional Name: 2-mercapto-4-methyl-besylic acid Formula: C7H8O3S2 MolecularWeight: 204.26662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H8O3S2/c1-5-2-3-7(6(11)4-5)12(8,9)10/h2-4,11H,1H3,(H,8,9,10)