ethyl (3S)-1-[3-(phenylmethyl)sulfonylpropanoyl]piperidine-3-carboxylate

Systemtic Name: ethyl (3S)-1-[3-(phenylmethyl)sulfonylpropanoyl]piperidine-3-carboxylate Openeye Name: ethyl (3S)-1-(3-benzylsulfonylpropanoyl)piperidine-3-carboxylate CAS Name: (3S)-1-[1-oxo-3-(phenylmethyl)sulfonylpropyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3S)-1-(3-benzylsulfonylpropanoyl)piperidine-3-carboxylate Traditional Name: (3S)-1-(3-benzylsulfonylpropanoyl)nipecotic acid ethyl ester Formula: C18H25NO5S MolecularWeight: 367.4598

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)[C@H]1CCCN(C1)C(=O)CCS(=O)(=O)CC2=CC=CC=C2

InChI

InChI=1S/C18H25NO5S/c1-2-24-18(21)16-9-6-11-19(13-16)17(20)10-12-25(22,23)14-15-7-4-3-5-8-15/h3-5,7-8,16H,2,6,9-14H2,1H3/t16-/m0/s1