1-[2-(3-cyanophenoxy)ethanoyl]-2-(2-oxidanylideneethoxy)pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-(3-cyanophenoxy)ethanoyl]-2-(2-oxidanylideneethoxy)pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-(3-cyanophenoxy)acetyl]-2-(2-oxoethoxy)pyrrolidine-2-carboxylic acid CAS Name: 1-[2-(3-cyanophenoxy)-1-oxoethyl]-2-(2-oxoethoxy)-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-(3-cyanophenoxy)acetyl]-2-(2-oxoethoxy)pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-(3-cyanophenoxy)acetyl]-2-(2-ketoethoxy)proline Formula: C16H16N2O6 MolecularWeight: 332.30804

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)COC2=CC=CC(=C2)C#N)(C(=O)O)OCC=O

Isomeric SMILES

C1CC(N(C1)C(=O)COC2=CC=CC(=C2)C#N)(C(=O)O)OCC=O

InChI

InChI=1S/C16H16N2O6/c17-10-12-3-1-4-13(9-12)23-11-14(20)18-6-2-5-16(18,15(21)22)24-8-7-19/h1,3-4,7,9H,2,5-6,8,11H2,(H,21,22)