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

Systemtic Name: tert-butyl (2S,5R)-2-(2-bromoethyl)-5-pyridin-3-yl-pyrrolidine-1-carboxylate Openeye Name: tert-butyl (2S,5R)-2-(2-bromoethyl)-5-(3-pyridyl)pyrrolidine-1-carboxylate CAS Name: (2S,5R)-2-(2-bromoethyl)-5-(3-pyridinyl)-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S,5R)-2-(2-bromoethyl)-5-pyridin-3-ylpyrrolidine-1-carboxylate Traditional Name: (2S,5R)-2-(2-bromoethyl)-5-(3-pyridyl)pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C16H23BrN2O2 MolecularWeight: 355.27002

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23BrN2O2/c1-16(2,3)21-15(20)19-13(8-9-17)6-7-14(19)12-5-4-10-18-11-12/h4-5,10-11,13-14H,6-9H2,1-3H3/t13-,14+/m0/s1