tert-butyl (2S,5S)-5-(2-oxidanylidenepropyl)pyrrolidine-2-carboxylate

Systemtic Name: tert-butyl (2S,5S)-5-(2-oxidanylidenepropyl)pyrrolidine-2-carboxylate Openeye Name: tert-butyl (2S,5S)-5-acetonylpyrrolidine-2-carboxylate CAS Name: (2S,5S)-5-(2-oxopropyl)-2-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S,5S)-5-(2-oxopropyl)pyrrolidine-2-carboxylate Traditional Name: (2S,5S)-5-acetonylpyrrolidine-2-carboxylic acid tert-butyl ester Formula: C12H21NO3 MolecularWeight: 227.30004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC1CCC(N1)C(=O)OC(C)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C12H21NO3/c1-8(14)7-9-5-6-10(13-9)11(15)16-12(2,3)4/h9-10,13H,5-7H2,1-4H3/t9-,10-/m0/s1