tert-butyl (2R,3S)-2-(hydroxymethyl)-5-methoxy-3-(phenylcarbonyloxy)pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (2R,3S)-2-(hydroxymethyl)-5-methoxy-3-(phenylcarbonyloxy)pyrrolidine-1-carboxylate Openeye Name: tert-butyl (2R,3S)-3-benzoyloxy-2-(hydroxymethyl)-5-methoxy-pyrrolidine-1-carboxylate CAS Name: (2R,3S)-3-benzoyloxy-2-(hydroxymethyl)-5-methoxy-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2R,3S)-3-benzoyloxy-2-(hydroxymethyl)-5-methoxypyrrolidine-1-carboxylate Traditional Name: (2R,3S)-3-benzoyloxy-5-methoxy-2-methylol-pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C18H25NO6 MolecularWeight: 351.3942

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C(CC(C1CO)OC(=O)C2=CC=CC=C2)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1[C@@H]([C@H](CC1OC)OC(=O)C2=CC=CC=C2)CO

InChI

InChI=1S/C18H25NO6/c1-18(2,3)25-17(22)19-13(11-20)14(10-15(19)23-4)24-16(21)12-8-6-5-7-9-12/h5-9,13-15,20H,10-11H2,1-4H3/t13-,14+,15?/m1/s1