1-methylsulfonyl-4-methylsulfonyloxy-piperidine-3-carboxylic acid

Systemtic Name: 1-methylsulfonyl-4-methylsulfonyloxy-piperidine-3-carboxylic acid Openeye Name: 1-methylsulfonyl-4-methylsulfonyloxy-piperidine-3-carboxylic acid CAS Name: 1-methylsulfonyl-4-methylsulfonyloxy-3-piperidinecarboxylic acid IUPAC Name: 1-methylsulfonyl-4-methylsulfonyloxypiperidine-3-carboxylic acid Traditional Name: 1-mesyl-4-methylsulfonyloxy-nipecotic acid Formula: C8H15NO7S2 MolecularWeight: 301.3372

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(C(C1)C(=O)O)OS(=O)(=O)C

Isomeric SMILES

CS(=O)(=O)N1CCC(C(C1)C(=O)O)OS(=O)(=O)C

InChI

InChI=1S/C8H15NO7S2/c1-17(12,13)9-4-3-7(16-18(2,14)15)6(5-9)8(10)11/h6-7H,3-5H2,1-2H3,(H,10,11)