ethyl 2-[(2S,5R)-6-(3-oxidanylpropyl)-5-(phenylsulfonyl)piperidin-2-yl]ethanoate

Systemtic Name: ethyl 2-[(2S,5R)-6-(3-oxidanylpropyl)-5-(phenylsulfonyl)piperidin-2-yl]ethanoate Openeye Name: ethyl 2-[(2S,5R)-5-(benzenesulfonyl)-6-(3-hydroxypropyl)-2-piperidyl]acetate CAS Name: 2-[(2S,5R)-5-(benzenesulfonyl)-6-(3-hydroxypropyl)-2-piperidinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[(2S,5R)-5-(benzenesulfonyl)-6-(3-hydroxypropyl)piperidin-2-yl]acetate Traditional Name: 2-[(2S,5R)-5-besyl-6-(3-hydroxypropyl)-2-piperidyl]acetic acid ethyl ester Formula: C18H27NO5S MolecularWeight: 369.47568

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1CCC(C(N1)CCCO)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C[C@@H]1CC[C@H](C(N1)CCCO)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H27NO5S/c1-2-24-18(21)13-14-10-11-17(16(19-14)9-6-12-20)25(22,23)15-7-4-3-5-8-15/h3-5,7-8,14,16-17,19-20H,2,6,9-13H2,1H3/t14-,16?,17+/m0/s1