tert-butyl (3S,4S,5R)-3-bromanyl-5-(2,2-dimethylpropanoyloxymethyl)-4-oxidanyl-piperidine-1-carboxylate

Systemtic Name: tert-butyl (3S,4S,5R)-3-bromanyl-5-(2,2-dimethylpropanoyloxymethyl)-4-oxidanyl-piperidine-1-carboxylate Openeye Name: tert-butyl (3S,4S,5R)-3-bromo-5-(2,2-dimethylpropanoyloxymethyl)-4-hydroxy-piperidine-1-carboxylate CAS Name: (3S,4S,5R)-3-bromo-5-[(2,2-dimethyl-1-oxopropoxy)methyl]-4-hydroxy-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (3S,4S,5R)-3-bromo-5-(2,2-dimethylpropanoyloxymethyl)-4-hydroxypiperidine-1-carboxylate Traditional Name: (3S,4S,5R)-3-bromo-4-hydroxy-5-(pivaloyloxymethyl)piperidine-1-carboxylic acid tert-butyl ester Formula: C16H28BrNO5 MolecularWeight: 394.30122

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OCC1CN(CC(C1O)Br)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)C(=O)OC[C@H]1CN(C[C@@H]([C@H]1O)Br)C(=O)OC(C)(C)C

InChI

InChI=1S/C16H28BrNO5/c1-15(2,3)13(20)22-9-10-7-18(8-11(17)12(10)19)14(21)23-16(4,5)6/h10-12,19H,7-9H2,1-6H3/t10-,11+,12+/m1/s1