tert-butyl (2R,5S)-2-(3-methylsulfonyloxypropyl)-5-pyridin-3-yl-pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (2R,5S)-2-(3-methylsulfonyloxypropyl)-5-pyridin-3-yl-pyrrolidine-1-carboxylate Openeye Name: tert-butyl (2R,5S)-2-(3-methylsulfonyloxypropyl)-5-(3-pyridyl)pyrrolidine-1-carboxylate CAS Name: (2R,5S)-2-(3-methylsulfonyloxypropyl)-5-(3-pyridinyl)-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2R,5S)-2-(3-methylsulfonyloxypropyl)-5-pyridin-3-ylpyrrolidine-1-carboxylate Traditional Name: (2R,5S)-2-(3-methylsulfonyloxypropyl)-5-(3-pyridyl)pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C18H28N2O5S MolecularWeight: 384.49032

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C(CCC1C2=CN=CC=C2)CCCOS(=O)(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C18H28N2O5S/c1-18(2,3)25-17(21)20-15(8-6-12-24-26(4,22)23)9-10-16(20)14-7-5-11-19-13-14/h5,7,11,13,15-16H,6,8-10,12H2,1-4H3/t15-,16-/m0/s1