ethyl 1-[2-(phenylmethyl)sulfonylethanoyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[2-(phenylmethyl)sulfonylethanoyl]piperidine-3-carboxylate Openeye Name: ethyl 1-(2-benzylsulfonylacetyl)piperidine-3-carboxylate CAS Name: 1-[1-oxo-2-(phenylmethyl)sulfonylethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-benzylsulfonylacetyl)piperidine-3-carboxylate Traditional Name: 1-(2-benzylsulfonylacetyl)nipecotic acid ethyl ester Formula: C17H23NO5S MolecularWeight: 353.43322

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)CS(=O)(=O)CC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)CS(=O)(=O)CC2=CC=CC=C2

InChI

InChI=1S/C17H23NO5S/c1-2-23-17(20)15-9-6-10-18(11-15)16(19)13-24(21,22)12-14-7-4-3-5-8-14/h3-5,7-8,15H,2,6,9-13H2,1H3