5-[3-methoxy-3-oxidanylidene-2-(phenylmethoxycarbonylamino)propyl]pyrrolidine-1,2-dicarboxylic acid

Systemtic Name: 5-[3-methoxy-3-oxidanylidene-2-(phenylmethoxycarbonylamino)propyl]pyrrolidine-1,2-dicarboxylic acid Openeye Name: 5-[2-(benzyloxycarbonylamino)-3-methoxy-3-oxo-propyl]pyrrolidine-1,2-dicarboxylic acid CAS Name: 5-[3-methoxy-3-oxo-2-(phenylmethoxycarbonylamino)propyl]pyrrolidine-1,2-dicarboxylic acid IUPAC Name: 5-[3-methoxy-3-oxo-2-(phenylmethoxycarbonylamino)propyl]pyrrolidine-1,2-dicarboxylic acid Traditional Name: 5-[2-(benzyloxycarbonylamino)-3-keto-3-methoxy-propyl]pyrrolidine-1,2-dicarboxylic acid Formula: C18H22N2O8 MolecularWeight: 394.37588

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1CCC(N1C(=O)O)C(=O)O)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

COC(=O)C(CC1CCC(N1C(=O)O)C(=O)O)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H22N2O8/c1-27-16(23)13(19-17(24)28-10-11-5-3-2-4-6-11)9-12-7-8-14(15(21)22)20(12)18(25)26/h2-6,12-14H,7-10H2,1H3,(H,19,24)(H,21,22)(H,25,26)