ethyl 1-(2-chloranylpyridin-3-yl)sulfonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-(2-chloranylpyridin-3-yl)sulfonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[(2-chloro-3-pyridyl)sulfonyl]piperidine-4-carboxylate CAS Name: 1-[(2-chloro-3-pyridinyl)sulfonyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-chloropyridin-3-yl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-[(2-chloro-3-pyridyl)sulfonyl]isonipecotic acid ethyl ester Formula: C13H17ClN2O4S MolecularWeight: 332.80308

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)S(=O)(=O)C2=C(N=CC=C2)Cl

Isomeric SMILES

CCOC(=O)C1CCN(CC1)S(=O)(=O)C2=C(N=CC=C2)Cl

InChI

InChI=1S/C13H17ClN2O4S/c1-2-20-13(17)10-5-8-16(9-6-10)21(18,19)11-4-3-7-15-12(11)14/h3-4,7,10H,2,5-6,8-9H2,1H3