tert-butyl 2-[(2R,5S)-5-methylsulfonyloxy-1-(phenylmethyl)piperidin-2-yl]ethanoate

Systemtic Name: tert-butyl 2-[(2R,5S)-5-methylsulfonyloxy-1-(phenylmethyl)piperidin-2-yl]ethanoate Openeye Name: tert-butyl 2-[(2R,5S)-1-benzyl-5-methylsulfonyloxy-2-piperidyl]acetate CAS Name: 2-[(2R,5S)-5-methylsulfonyloxy-1-(phenylmethyl)-2-piperidinyl]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(2R,5S)-1-benzyl-5-methylsulfonyloxypiperidin-2-yl]acetate Traditional Name: 2-[(2R,5S)-1-benzyl-5-methylsulfonyloxy-2-piperidyl]acetic acid tert-butyl ester Formula: C19H29NO5S MolecularWeight: 383.50226

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CC1CCC(CN1CC2=CC=CC=C2)OS(=O)(=O)C

Isomeric SMILES

CC(C)(C)OC(=O)C[C@H]1CC[C@@H](CN1CC2=CC=CC=C2)OS(=O)(=O)C

InChI

InChI=1S/C19H29NO5S/c1-19(2,3)24-18(21)12-16-10-11-17(25-26(4,22)23)14-20(16)13-15-8-6-5-7-9-15/h5-9,16-17H,10-14H2,1-4H3/t16-,17+/m1/s1