O3-tert-butyl O2-(phenylmethyl) (2R)-1-[(2S)-2-azanylpropanoyl]-2-cyano-pyrrolidine-2,3-dicarboxylate

Systemtic Name: O3-tert-butyl O2-(phenylmethyl) (2R)-1-[(2S)-2-azanylpropanoyl]-2-cyano-pyrrolidine-2,3-dicarboxylate Openeye Name: O2-benzyl O3-tert-butyl (2R)-1-[(2S)-2-aminopropanoyl]-2-cyano-pyrrolidine-2,3-dicarboxylate CAS Name: (2R)-1-[(2S)-2-amino-1-oxopropyl]-2-cyanopyrrolidine-2,3-dicarboxylic acid O3-tert-butyl ester O2-(phenylmethyl) ester IUPAC Name: 2-O-benzyl 3-O-tert-butyl (2R)-1-[(2S)-2-aminopropanoyl]-2-cyanopyrrolidine-2,3-dicarboxylate Traditional Name: (2R)-1-[(2S)-2-aminopropanoyl]-2-cyano-pyrrolidine-2,3-dicarboxylic acid O2-benzyl ester O3-tert-butyl ester Formula: C21H27N3O5 MolecularWeight: 401.45618

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC(C1(C#N)C(=O)OCC2=CC=CC=C2)C(=O)OC(C)(C)C)N

Isomeric SMILES

C[C@@H](C(=O)N1CCC([C@@]1(C#N)C(=O)OCC2=CC=CC=C2)C(=O)OC(C)(C)C)N

InChI

InChI=1S/C21H27N3O5/c1-14(23)17(25)24-11-10-16(18(26)29-20(2,3)4)21(24,13-22)19(27)28-12-15-8-6-5-7-9-15/h5-9,14,16H,10-12,23H2,1-4H3/t14-,16?,21-/m0/s1