1,1,2,2-tetradeuterio-2-(phenylcarbonylsulfanyl)ethanesulfonic acid

Systemtic Name: 1,1,2,2-tetradeuterio-2-(phenylcarbonylsulfanyl)ethanesulfonic acid Openeye Name: 2-benzoylsulfanyl-1,1,2,2-tetradeuterio-ethanesulfonic acid CAS Name: 2-(benzoylthio)-1,1,2,2-tetradeuterioethanesulfonic acid IUPAC Name: 2-benzoylsulfanyl-1,1,2,2-tetradeuterioethanesulfonic acid Traditional Name: 2-(benzoylthio)-1,1,2,2-tetradeuterio-ethanesulfonic acid Formula: C9H10O4S2 MolecularWeight: 250.327947

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)SCCS(=O)(=O)O

Isomeric SMILES

[2H]C([2H])(C([2H])([2H])S(=O)(=O)O)SC(=O)C1=CC=CC=C1

InChI

InChI=1S/C9H10O4S2/c10-9(8-4-2-1-3-5-8)14-6-7-15(11,12)13/h1-5H,6-7H2,(H,11,12,13)/i6D2,7D2