(phenylmethyl) 1-[2-[cyano-[(2-methylpropan-2-yl)oxycarbonyl]amino]propanoyl]pyrrolidine-2-carboxylate

Systemtic Name: (phenylmethyl) 1-[2-[cyano-[(2-methylpropan-2-yl)oxycarbonyl]amino]propanoyl]pyrrolidine-2-carboxylate Openeye Name: benzyl 1-[2-[tert-butoxycarbonyl(cyano)amino]propanoyl]pyrrolidine-2-carboxylate CAS Name: 1-[2-[cyano-[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxopropyl]-2-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 1-[2-[cyano-[(2-methylpropan-2-yl)oxycarbonyl]amino]propanoyl]pyrrolidine-2-carboxylate Traditional Name: 1-[2-[tert-butoxycarbonyl(cyano)amino]propanoyl]pyrrolidine-2-carboxylic acid benzyl ester Formula: C21H27N3O5 MolecularWeight: 401.45618

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCC1C(=O)OCC2=CC=CC=C2)N(C#N)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C(=O)N1CCCC1C(=O)OCC2=CC=CC=C2)N(C#N)C(=O)OC(C)(C)C

InChI

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