3-(2-carboxypyrrolidin-1-yl)-2-(2-oxidanylideneethoxy)-1-[2-(3-oxidanylphenoxy)ethanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 3-(2-carboxypyrrolidin-1-yl)-2-(2-oxidanylideneethoxy)-1-[2-(3-oxidanylphenoxy)ethanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 3-(2-carboxypyrrolidin-1-yl)-1-[2-(3-hydroxyphenoxy)acetyl]-2-(2-oxoethoxy)pyrrolidine-2-carboxylic acid CAS Name: 3-(2-carboxy-1-pyrrolidinyl)-1-[2-(3-hydroxyphenoxy)-1-oxoethyl]-2-(2-oxoethoxy)-2-pyrrolidinecarboxylic acid IUPAC Name: 3-(2-carboxypyrrolidin-1-yl)-1-[2-(3-hydroxyphenoxy)acetyl]-2-(2-oxoethoxy)pyrrolidine-2-carboxylic acid Traditional Name: 3-(2-carboxypyrrolidino)-1-[2-(3-hydroxyphenoxy)acetyl]-2-(2-ketoethoxy)proline Formula: C20H24N2O9 MolecularWeight: 436.41256

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C2CCN(C2(C(=O)O)OCC=O)C(=O)COC3=CC=CC(=C3)O)C(=O)O

Isomeric SMILES

C1CC(N(C1)C2CCN(C2(C(=O)O)OCC=O)C(=O)COC3=CC=CC(=C3)O)C(=O)O

InChI

InChI=1S/C20H24N2O9/c23-9-10-31-20(19(28)29)16(21-7-2-5-15(21)18(26)27)6-8-22(20)17(25)12-30-14-4-1-3-13(24)11-14/h1,3-4,9,11,15-16,24H,2,5-8,10,12H2,(H,26,27)(H,28,29)