tert-butyl (2S,5R)-2-(acetyloxymethyl)-5-(hydroxymethyl)-2,5-dihydropyrrole-1-carboxylate

Systemtic Name: tert-butyl (2S,5R)-2-(acetyloxymethyl)-5-(hydroxymethyl)-2,5-dihydropyrrole-1-carboxylate Openeye Name: tert-butyl (2S,5R)-2-(acetoxymethyl)-5-(hydroxymethyl)-2,5-dihydropyrrole-1-carboxylate CAS Name: (2S,5R)-2-(acetyloxymethyl)-5-(hydroxymethyl)-2,5-dihydropyrrole-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S,5R)-2-(acetyloxymethyl)-5-(hydroxymethyl)-2,5-dihydropyrrole-1-carboxylate Traditional Name: (2S,5R)-2-(acetoxymethyl)-5-methylol-3-pyrroline-1-carboxylic acid tert-butyl ester Formula: C13H21NO5 MolecularWeight: 271.30954

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C=CC(N1C(=O)OC(C)(C)C)CO

Isomeric SMILES

CC(=O)OC[C@@H]1C=C[C@@H](N1C(=O)OC(C)(C)C)CO

InChI

InChI=1S/C13H21NO5/c1-9(16)18-8-11-6-5-10(7-15)14(11)12(17)19-13(2,3)4/h5-6,10-11,15H,7-8H2,1-4H3/t10-,11+/m1/s1