1-[2-[(2-ethoxy-2-oxidanylidene-ethyl)-phenylmethoxycarbonyl-amino]propanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-[(2-ethoxy-2-oxidanylidene-ethyl)-phenylmethoxycarbonyl-amino]propanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-[benzyloxycarbonyl-(2-ethoxy-2-oxo-ethyl)amino]propanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[(2-ethoxy-2-oxoethyl)-phenylmethoxycarbonylamino]-1-oxopropyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-[(2-ethoxy-2-oxoethyl)-phenylmethoxycarbonylamino]propanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-[carbobenzoxy-(2-ethoxy-2-keto-ethyl)amino]propanoyl]proline Formula: C20H26N2O7 MolecularWeight: 406.42964

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(C(C)C(=O)N1CCCC1C(=O)O)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)CN(C(C)C(=O)N1CCCC1C(=O)O)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C20H26N2O7/c1-3-28-17(23)12-22(20(27)29-13-15-8-5-4-6-9-15)14(2)18(24)21-11-7-10-16(21)19(25)26/h4-6,8-9,14,16H,3,7,10-13H2,1-2H3,(H,25,26)