ethyl 1-(1-pyridin-3-ylsulfonylpiperidin-4-yl)carbonylpiperidine-3-carboxylate

Systemtic Name: ethyl 1-(1-pyridin-3-ylsulfonylpiperidin-4-yl)carbonylpiperidine-3-carboxylate Openeye Name: ethyl 1-[1-(3-pyridylsulfonyl)piperidine-4-carbonyl]piperidine-3-carboxylate CAS Name: 1-[oxo-[1-(3-pyridinylsulfonyl)-4-piperidinyl]methyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(1-pyridin-3-ylsulfonylpiperidine-4-carbonyl)piperidine-3-carboxylate Traditional Name: 1-[1-(3-pyridylsulfonyl)isonipecotoyl]nipecotic acid ethyl ester Formula: C19H27N3O5S MolecularWeight: 409.49978

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2CCN(CC2)S(=O)(=O)C3=CN=CC=C3

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)C2CCN(CC2)S(=O)(=O)C3=CN=CC=C3

InChI

InChI=1S/C19H27N3O5S/c1-2-27-19(24)16-5-4-10-21(14-16)18(23)15-7-11-22(12-8-15)28(25,26)17-6-3-9-20-13-17/h3,6,9,13,15-16H,2,4-5,7-8,10-12,14H2,1H3