pyridin-2-ylmethyl 1-methylsulfonylpiperidine-4-carboxylate

Systemtic Name: pyridin-2-ylmethyl 1-methylsulfonylpiperidine-4-carboxylate Openeye Name: 2-pyridylmethyl 1-methylsulfonylpiperidine-4-carboxylate CAS Name: 1-methylsulfonyl-4-piperidinecarboxylic acid 2-pyridinylmethyl ester IUPAC Name: pyridin-2-ylmethyl 1-methylsulfonylpiperidine-4-carboxylate Traditional Name: 1-mesylisonipecotic acid 2-pyridylmethyl ester Formula: C13H18N2O4S MolecularWeight: 298.35802

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(CC1)C(=O)OCC2=CC=CC=N2

Isomeric SMILES

CS(=O)(=O)N1CCC(CC1)C(=O)OCC2=CC=CC=N2

InChI

InChI=1S/C13H18N2O4S/c1-20(17,18)15-8-5-11(6-9-15)13(16)19-10-12-4-2-3-7-14-12/h2-4,7,11H,5-6,8-10H2,1H3