1-pyridin-1-ium-3-ylsulfonylpiperidine-4-carboxylate

Systemtic Name: 1-pyridin-1-ium-3-ylsulfonylpiperidine-4-carboxylate Openeye Name: 1-pyridin-1-ium-3-ylsulfonylpiperidine-4-carboxylate CAS Name: 1-(3-pyridin-1-iumylsulfonyl)-4-piperidinecarboxylate IUPAC Name: 1-pyridin-1-ium-3-ylsulfonylpiperidine-4-carboxylate Traditional Name: 1-pyridin-1-ium-3-ylsulfonylisonipecotate Formula: C11H14N2O4S MolecularWeight: 270.30486

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)[O-])S(=O)(=O)C2=C[NH+]=CC=C2

Isomeric SMILES

C1CN(CCC1C(=O)[O-])S(=O)(=O)C2=C[NH+]=CC=C2

InChI

InChI=1S/C11H14N2O4S/c14-11(15)9-3-6-13(7-4-9)18(16,17)10-2-1-5-12-8-10/h1-2,5,8-9H,3-4,6-7H2,(H,14,15)