1-(1-methylsulfonylpiperidin-2-yl)carbonylpiperidine-3-carboxylic acid

Systemtic Name: 1-(1-methylsulfonylpiperidin-2-yl)carbonylpiperidine-3-carboxylic acid Openeye Name: 1-(1-methylsulfonylpiperidine-2-carbonyl)piperidine-3-carboxylic acid CAS Name: 1-[(1-methylsulfonyl-2-piperidinyl)-oxomethyl]-3-piperidinecarboxylic acid IUPAC Name: 1-(1-methylsulfonylpiperidine-2-carbonyl)piperidine-3-carboxylic acid Traditional Name: 1-(1-mesylpipecoloyl)nipecotic acid Formula: C13H22N2O5S MolecularWeight: 318.38918

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCCCC1C(=O)N2CCCC(C2)C(=O)O

Isomeric SMILES

CS(=O)(=O)N1CCCCC1C(=O)N2CCCC(C2)C(=O)O

InChI

InChI=1S/C13H22N2O5S/c1-21(19,20)15-8-3-2-6-11(15)12(16)14-7-4-5-10(9-14)13(17)18/h10-11H,2-9H2,1H3,(H,17,18)