[4-carboxyoxy-2,3-bis(sulfanyl)cyclohexyl] hydrogen carbonate

Systemtic Name: [4-carboxyoxy-2,3-bis(sulfanyl)cyclohexyl] hydrogen carbonate Openeye Name: [4-carboxyoxy-2,3-bis(sulfanyl)cyclohexyl] hydrogen carbonate CAS Name: carbonic acid (4-carboxyoxy-2,3-dimercaptocyclohexyl) ester IUPAC Name: [4-carboxyoxy-2,3-bis(sulfanyl)cyclohexyl] hydrogen carbonate Traditional Name: carbonic acid (4-carboxyoxy-2,3-dimercapto-cyclohexyl) ester Formula: C8H12O6S2 MolecularWeight: 268.30728

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(C(C1OC(=O)O)S)S)OC(=O)O

Isomeric SMILES

C1CC(C(C(C1OC(=O)O)S)S)OC(=O)O

InChI

InChI=1S/C8H12O6S2/c9-7(10)13-3-1-2-4(14-8(11)12)6(16)5(3)15/h3-6,15-16H,1-2H2,(H,9,10)(H,11,12)