O1-tert-butyl O2-methyl (2S,4R)-4-(cyanomethyl)pyrrolidine-1,2-dicarboxylate

Systemtic Name: O1-tert-butyl O2-methyl (2S,4R)-4-(cyanomethyl)pyrrolidine-1,2-dicarboxylate Openeye Name: O1-tert-butyl O2-methyl (2S,4R)-4-(cyanomethyl)pyrrolidine-1,2-dicarboxylate CAS Name: (2S,4R)-4-(cyanomethyl)pyrrolidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-methyl ester IUPAC Name: 1-O-tert-butyl 2-O-methyl (2S,4R)-4-(cyanomethyl)pyrrolidine-1,2-dicarboxylate Traditional Name: (2S,4R)-4-(cyanomethyl)pyrrolidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-methyl ester Formula: C13H20N2O4 MolecularWeight: 268.3089

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(CC1C(=O)OC)CC#N

Isomeric SMILES

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

InChI

InChI=1S/C13H20N2O4/c1-13(2,3)19-12(17)15-8-9(5-6-14)7-10(15)11(16)18-4/h9-10H,5,7-8H2,1-4H3/t9-,10-/m0/s1