1-(2-chloranylethanoyl)pyrrolidine-2-carboxylic acid; 1-ethanoylpyrrolidine-2-carboxylic acid

Systemtic Name: 1-(2-chloranylethanoyl)pyrrolidine-2-carboxylic acid; 1-ethanoylpyrrolidine-2-carboxylic acid Openeye Name: 1-acetylpyrrolidine-2-carboxylic acid; 1-(2-chloroacetyl)pyrrolidine-2-carboxylic acid CAS Name: 1-acetyl-2-pyrrolidinecarboxylic acid; 1-(2-chloro-1-oxoethyl)-2-pyrrolidinecarboxylic acid IUPAC Name: 1-acetylpyrrolidine-2-carboxylic acid; 1-(2-chloroacetyl)pyrrolidine-2-carboxylic acid Traditional Name: 1-acetylproline; 1-(2-chloroacetyl)proline Formula: C14H21ClN2O6 MolecularWeight: 348.77934

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCCC1C(=O)O.C1CC(N(C1)C(=O)CCl)C(=O)O

Isomeric SMILES

CC(=O)N1CCCC1C(=O)O.C1CC(N(C1)C(=O)CCl)C(=O)O

InChI

InChI=1S/C7H10ClNO3.C7H11NO3/c8-4-6(10)9-3-1-2-5(9)7(11)12;1-5(9)8-4-2-3-6(8)7(10)11/h5H,1-4H2,(H,11,12);6H,2-4H2,1H3,(H,10,11)