4-[1,2-bis(sulfanyl)ethyl]benzenesulfonic acid

Systemtic Name: 4-[1,2-bis(sulfanyl)ethyl]benzenesulfonic acid Openeye Name: 4-[1,2-bis(sulfanyl)ethyl]benzenesulfonic acid CAS Name: 4-(1,2-dimercaptoethyl)benzenesulfonic acid IUPAC Name: 4-[1,2-bis(sulfanyl)ethyl]benzenesulfonic acid Traditional Name: 4-(1,2-dimercaptoethyl)besylic acid Formula: C8H10O3S3 MolecularWeight: 250.3582

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(CS)S)S(=O)(=O)O

Isomeric SMILES

C1=CC(=CC=C1C(CS)S)S(=O)(=O)O

InChI

InChI=1S/C8H10O3S3/c9-14(10,11)7-3-1-6(2-4-7)8(13)5-12/h1-4,8,12-13H,5H2,(H,9,10,11)