(2S,3S)-3-(cyanomethyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid

Systemtic Name: (2S,3S)-3-(cyanomethyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid Openeye Name: (2S,3S)-1-tert-butoxycarbonyl-3-(cyanomethyl)pyrrolidine-2-carboxylic acid CAS Name: (2S,3S)-3-(cyanomethyl)-1-[(2-methylpropan-2-yl)oxy-oxomethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2S,3S)-3-(cyanomethyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid Traditional Name: (2S,3S)-1-tert-butoxycarbonyl-3-(cyanomethyl)proline Formula: C12H18N2O4 MolecularWeight: 254.28232

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(C1C(=O)O)CC#N

Isomeric SMILES

CC(C)(C)OC(=O)N1CC[C@H]([C@H]1C(=O)O)CC#N

InChI

InChI=1S/C12H18N2O4/c1-12(2,3)18-11(17)14-7-5-8(4-6-13)9(14)10(15)16/h8-9H,4-5,7H2,1-3H3,(H,15,16)/t8-,9+/m1/s1