tert-butyl (2R,3S,5S)-5-(2-bromoethyl)-3-oxidanyl-1-(phenylsulfonyl)pyrrolidine-2-carboxylate

Systemtic Name: tert-butyl (2R,3S,5S)-5-(2-bromoethyl)-3-oxidanyl-1-(phenylsulfonyl)pyrrolidine-2-carboxylate Openeye Name: tert-butyl (2R,3S,5S)-1-(benzenesulfonyl)-5-(2-bromoethyl)-3-hydroxy-pyrrolidine-2-carboxylate CAS Name: (2R,3S,5S)-1-(benzenesulfonyl)-5-(2-bromoethyl)-3-hydroxy-2-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2R,3S,5S)-1-(benzenesulfonyl)-5-(2-bromoethyl)-3-hydroxypyrrolidine-2-carboxylate Traditional Name: (2R,3S,5S)-1-besyl-5-(2-bromoethyl)-3-hydroxy-pyrrolidine-2-carboxylic acid tert-butyl ester Formula: C17H24BrNO5S MolecularWeight: 434.34516

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1C(CC(N1S(=O)(=O)C2=CC=CC=C2)CCBr)O

Isomeric SMILES

CC(C)(C)OC(=O)[C@H]1[C@H](C[C@H](N1S(=O)(=O)C2=CC=CC=C2)CCBr)O

InChI

InChI=1S/C17H24BrNO5S/c1-17(2,3)24-16(21)15-14(20)11-12(9-10-18)19(15)25(22,23)13-7-5-4-6-8-13/h4-8,12,14-15,20H,9-11H2,1-3H3/t12-,14+,15-/m1/s1