1-[2-[[2-(2,2-dimethylpropanoyloxymethoxycarbonyl)phenyl]carbonylamino]propanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-[[2-(2,2-dimethylpropanoyloxymethoxycarbonyl)phenyl]carbonylamino]propanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-[[2-(2,2-dimethylpropanoyloxymethoxycarbonyl)benzoyl]amino]propanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[[[2-[(2,2-dimethyl-1-oxopropoxy)methoxy-oxomethyl]phenyl]-oxomethyl]amino]-1-oxopropyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-[[2-(2,2-dimethylpropanoyloxymethoxycarbonyl)benzoyl]amino]propanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-[[2-(pivaloyloxymethoxycarbonyl)benzoyl]amino]propanoyl]proline Formula: C22H28N2O8 MolecularWeight: 448.46632

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCC1C(=O)O)NC(=O)C2=CC=CC=C2C(=O)OCOC(=O)C(C)(C)C

Isomeric SMILES

CC(C(=O)N1CCCC1C(=O)O)NC(=O)C2=CC=CC=C2C(=O)OCOC(=O)C(C)(C)C

InChI

InChI=1S/C22H28N2O8/c1-13(18(26)24-11-7-10-16(24)19(27)28)23-17(25)14-8-5-6-9-15(14)20(29)31-12-32-21(30)22(2,3)4/h5-6,8-9,13,16H,7,10-12H2,1-4H3,(H,23,25)(H,27,28)