(2R,4S)-1-(2-bromanyl-4-fluoranyl-phenyl)carbonyl-4-methoxy-pyrrolidine-2-carboxylic acid

Systemtic Name: (2R,4S)-1-(2-bromanyl-4-fluoranyl-phenyl)carbonyl-4-methoxy-pyrrolidine-2-carboxylic acid Openeye Name: (2R,4S)-1-(2-bromo-4-fluoro-benzoyl)-4-methoxy-pyrrolidine-2-carboxylic acid CAS Name: (2R,4S)-1-[(2-bromo-4-fluorophenyl)-oxomethyl]-4-methoxy-2-pyrrolidinecarboxylic acid IUPAC Name: (2R,4S)-1-(2-bromo-4-fluorobenzoyl)-4-methoxypyrrolidine-2-carboxylic acid Traditional Name: (2R,4S)-1-(2-bromo-4-fluoro-benzoyl)-4-methoxy-proline Formula: C13H13BrFNO4 MolecularWeight: 346.149023

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Descriptors Computed from Structure

Canonical SMILES:

COC1CC(N(C1)C(=O)C2=C(C=C(C=C2)F)Br)C(=O)O

Isomeric SMILES

CO[C@H]1C[C@@H](N(C1)C(=O)C2=C(C=C(C=C2)F)Br)C(=O)O

InChI

InChI=1S/C13H13BrFNO4/c1-20-8-5-11(13(18)19)16(6-8)12(17)9-3-2-7(15)4-10(9)14/h2-4,8,11H,5-6H2,1H3,(H,18,19)/t8-,11+/m0/s1