(1-methylpyridin-1-ium-3-yl) piperidine-1-carboxylate

Systemtic Name: (1-methylpyridin-1-ium-3-yl) piperidine-1-carboxylate Openeye Name: (1-methylpyridin-1-ium-3-yl) piperidine-1-carboxylate CAS Name: 1-piperidinecarboxylic acid (1-methyl-3-pyridin-1-iumyl) ester IUPAC Name: (1-methylpyridin-1-ium-3-yl) piperidine-1-carboxylate Traditional Name: piperidine-1-carboxylic acid (1-methylpyridin-1-ium-3-yl) ester Formula: C12H17N2O2+ MolecularWeight: 221.27558

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=CC(=C1)OC(=O)N2CCCCC2

Isomeric SMILES

C[N+]1=CC=CC(=C1)OC(=O)N2CCCCC2

InChI

InChI=1S/C12H17N2O2/c1-13-7-5-6-11(10-13)16-12(15)14-8-3-2-4-9-14/h5-7,10H,2-4,8-9H2,1H3/q+1