1-[2-(4-bromanyl-2-chloranyl-phenoxy)ethanoyl]-4-oxidanyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-(4-bromanyl-2-chloranyl-phenoxy)ethanoyl]-4-oxidanyl-pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-(4-bromo-2-chloro-phenoxy)acetyl]-4-hydroxy-pyrrolidine-2-carboxylic acid CAS Name: 1-[2-(4-bromo-2-chlorophenoxy)-1-oxoethyl]-4-hydroxy-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-(4-bromo-2-chlorophenoxy)acetyl]-4-hydroxypyrrolidine-2-carboxylic acid Traditional Name: 1-[2-(4-bromo-2-chloro-phenoxy)acetyl]-4-hydroxy-proline Formula: C13H13BrClNO5 MolecularWeight: 378.60302

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1C(=O)O)C(=O)COC2=C(C=C(C=C2)Br)Cl)O

Isomeric SMILES

C1C(CN(C1C(=O)O)C(=O)COC2=C(C=C(C=C2)Br)Cl)O

InChI

InChI=1S/C13H13BrClNO5/c14-7-1-2-11(9(15)3-7)21-6-12(18)16-5-8(17)4-10(16)13(19)20/h1-3,8,10,17H,4-6H2,(H,19,20)