tert-butyl (2R,5S)-2-(4-chloranylpyridin-3-yl)-5-(hydroxymethyl)pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (2R,5S)-2-(4-chloranylpyridin-3-yl)-5-(hydroxymethyl)pyrrolidine-1-carboxylate Openeye Name: tert-butyl (2R,5S)-2-(4-chloro-3-pyridyl)-5-(hydroxymethyl)pyrrolidine-1-carboxylate CAS Name: (2R,5S)-2-(4-chloro-3-pyridinyl)-5-(hydroxymethyl)-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2R,5S)-2-(4-chloropyridin-3-yl)-5-(hydroxymethyl)pyrrolidine-1-carboxylate Traditional Name: (2R,5S)-2-(4-chloro-3-pyridyl)-5-methylol-pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C15H21ClN2O3 MolecularWeight: 312.79184

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C(CCC1C2=C(C=CN=C2)Cl)CO

Isomeric SMILES

CC(C)(C)OC(=O)N1[C@@H](CC[C@@H]1C2=C(C=CN=C2)Cl)CO

InChI

InChI=1S/C15H21ClN2O3/c1-15(2,3)21-14(20)18-10(9-19)4-5-13(18)11-8-17-7-6-12(11)16/h6-8,10,13,19H,4-5,9H2,1-3H3/t10-,13+/m0/s1