ethyl 2-[(3S,4S)-4-oxidanyl-1-(phenylsulfonyl)piperidin-3-yl]ethanoate

Systemtic Name: ethyl 2-[(3S,4S)-4-oxidanyl-1-(phenylsulfonyl)piperidin-3-yl]ethanoate Openeye Name: ethyl 2-[(3S,4S)-1-(benzenesulfonyl)-4-hydroxy-3-piperidyl]acetate CAS Name: 2-[(3S,4S)-1-(benzenesulfonyl)-4-hydroxy-3-piperidinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[(3S,4S)-1-(benzenesulfonyl)-4-hydroxypiperidin-3-yl]acetate Traditional Name: 2-[(3S,4S)-1-besyl-4-hydroxy-3-piperidyl]acetic acid ethyl ester Formula: C15H21NO5S MolecularWeight: 327.39594

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1CN(CCC1O)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C15H21NO5S/c1-2-21-15(18)10-12-11-16(9-8-14(12)17)22(19,20)13-6-4-3-5-7-13/h3-7,12,14,17H,2,8-11H2,1H3/t12-,14-/m0/s1