1-[2-[[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethyl]-phenylmethoxycarbonyl-amino]propanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-[[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethyl]-phenylmethoxycarbonyl-amino]propanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-[benzyloxycarbonyl-(2-tert-butoxy-2-oxo-ethyl)amino]propanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-phenylmethoxycarbonylamino]-1-oxopropyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-[[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-phenylmethoxycarbonylamino]propanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-[(2-tert-butoxy-2-keto-ethyl)-carbobenzoxy-amino]propanoyl]proline Formula: C22H30N2O7 MolecularWeight: 434.4828

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H30N2O7/c1-15(19(26)23-12-8-11-17(23)20(27)28)24(13-18(25)31-22(2,3)4)21(29)30-14-16-9-6-5-7-10-16/h5-7,9-10,15,17H,8,11-14H2,1-4H3,(H,27,28)