2-ethylsulfanyl-6-methyl-benzenesulfonic acid

Systemtic Name: 2-ethylsulfanyl-6-methyl-benzenesulfonic acid Openeye Name: 2-ethylsulfanyl-6-methyl-benzenesulfonic acid CAS Name: 2-(ethylthio)-6-methylbenzenesulfonic acid IUPAC Name: 2-ethylsulfanyl-6-methylbenzenesulfonic acid Traditional Name: 2-(ethylthio)-6-methyl-besylic acid Formula: C9H12O3S2 MolecularWeight: 232.31978

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=CC(=C1S(=O)(=O)O)C

Isomeric SMILES

CCSC1=CC=CC(=C1S(=O)(=O)O)C

InChI

InChI=1S/C9H12O3S2/c1-3-13-8-6-4-5-7(2)9(8)14(10,11)12/h4-6H,3H2,1-2H3,(H,10,11,12)