(5E)-5-[2-(4-chlorophenyl)-1-cyano-2-oxidanylidene-ethylidene]pyrrolidine-2-carboxylic acid

Systemtic Name: (5E)-5-[2-(4-chlorophenyl)-1-cyano-2-oxidanylidene-ethylidene]pyrrolidine-2-carboxylic acid Openeye Name: (5E)-5-[2-(4-chlorophenyl)-1-cyano-2-oxo-ethylidene]pyrrolidine-2-carboxylic acid CAS Name: (5E)-5-[2-(4-chlorophenyl)-1-cyano-2-oxoethylidene]-2-pyrrolidinecarboxylic acid IUPAC Name: (5E)-5-[2-(4-chlorophenyl)-1-cyano-2-oxoethylidene]pyrrolidine-2-carboxylic acid Traditional Name: (5E)-5-[2-(4-chlorophenyl)-1-cyano-2-keto-ethylidene]proline Formula: C14H11ClN2O3 MolecularWeight: 290.70174

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=C(C#N)C(=O)C2=CC=C(C=C2)Cl)NC1C(=O)O

Isomeric SMILES

C1C/C(=C(/C#N)\C(=O)C2=CC=C(C=C2)Cl)/NC1C(=O)O

InChI

InChI=1S/C14H11ClN2O3/c15-9-3-1-8(2-4-9)13(18)10(7-16)11-5-6-12(17-11)14(19)20/h1-4,12,17H,5-6H2,(H,19,20)/b11-10+