1-methylsulfonylpiperidine-4-carboxylic acid

Systemtic Name: 1-methylsulfonylpiperidine-4-carboxylic acid Openeye Name: 1-methylsulfonylpiperidine-4-carboxylic acid CAS Name: 1-methylsulfonyl-4-piperidinecarboxylic acid IUPAC Name: 1-methylsulfonylpiperidine-4-carboxylic acid Traditional Name: 1-mesylisonipecotic acid Formula: C7H13NO4S MolecularWeight: 207.24742

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(CC1)C(=O)O

Isomeric SMILES

CS(=O)(=O)N1CCC(CC1)C(=O)O

InChI

InChI=1S/C7H13NO4S/c1-13(11,12)8-4-2-6(3-5-8)7(9)10/h6H,2-5H2,1H3,(H,9,10)