(2S,4S)-1-(2-bromophenyl)carbonyl-4-propan-2-ylsulfonyloxy-pyrrolidine-2-carboxylic acid

Systemtic Name: (2S,4S)-1-(2-bromophenyl)carbonyl-4-propan-2-ylsulfonyloxy-pyrrolidine-2-carboxylic acid Openeye Name: (2S,4S)-1-(2-bromobenzoyl)-4-isopropylsulfonyloxy-pyrrolidine-2-carboxylic acid CAS Name: (2S,4S)-1-[(2-bromophenyl)-oxomethyl]-4-propan-2-ylsulfonyloxy-2-pyrrolidinecarboxylic acid IUPAC Name: (2S,4S)-1-(2-bromobenzoyl)-4-propan-2-ylsulfonyloxypyrrolidine-2-carboxylic acid Traditional Name: (2S,4S)-1-(2-bromobenzoyl)-4-isopropylsulfonyloxy-proline Formula: C15H18BrNO6S MolecularWeight: 420.27552

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)OC1CC(N(C1)C(=O)C2=CC=CC=C2Br)C(=O)O

Isomeric SMILES

CC(C)S(=O)(=O)O[C@H]1C[C@H](N(C1)C(=O)C2=CC=CC=C2Br)C(=O)O

InChI

InChI=1S/C15H18BrNO6S/c1-9(2)24(21,22)23-10-7-13(15(19)20)17(8-10)14(18)11-5-3-4-6-12(11)16/h3-6,9-10,13H,7-8H2,1-2H3,(H,19,20)/t10-,13-/m0/s1