1-[2-(3-bromanylphenoxy)ethanoyl]-4-oxidanyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-(3-bromanylphenoxy)ethanoyl]-4-oxidanyl-pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-(3-bromophenoxy)acetyl]-4-hydroxy-pyrrolidine-2-carboxylic acid CAS Name: 1-[2-(3-bromophenoxy)-1-oxoethyl]-4-hydroxy-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-(3-bromophenoxy)acetyl]-4-hydroxypyrrolidine-2-carboxylic acid Traditional Name: 1-[2-(3-bromophenoxy)acetyl]-4-hydroxy-proline Formula: C13H14BrNO5 MolecularWeight: 344.15796

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14BrNO5/c14-8-2-1-3-10(4-8)20-7-12(17)15-6-9(16)5-11(15)13(18)19/h1-4,9,11,16H,5-7H2,(H,18,19)