tert-butyl (2R,5S)-2-(cyanomethyl)-5-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (2R,5S)-2-(cyanomethyl)-5-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl (2S,5R)-2-[(tert-butoxycarbonylamino)methyl]-5-(cyanomethyl)pyrrolidine-1-carboxylate CAS Name: (2R,5S)-2-(cyanomethyl)-5-[[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]methyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2R,5S)-2-(cyanomethyl)-5-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]pyrrolidine-1-carboxylate Traditional Name: (2S,5R)-2-[(tert-butoxycarbonylamino)methyl]-5-(cyanomethyl)pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C17H29N3O4 MolecularWeight: 339.42986

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC1CCC(N1C(=O)OC(C)(C)C)CC#N

Isomeric SMILES

CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](N1C(=O)OC(C)(C)C)CC#N

InChI

InChI=1S/C17H29N3O4/c1-16(2,3)23-14(21)19-11-13-8-7-12(9-10-18)20(13)15(22)24-17(4,5)6/h12-13H,7-9,11H2,1-6H3,(H,19,21)/t12-,13+/m1/s1