1-[(3-bromophenyl)-[4-(trifluoromethyl)phenyl]methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(3-bromophenyl)-[4-(trifluoromethyl)phenyl]methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(3-bromophenyl)-[4-(trifluoromethyl)phenyl]methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(3-bromophenyl)-[4-(trifluoromethyl)phenyl]methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(3-bromophenyl)-[4-(trifluoromethyl)phenyl]methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(3-bromophenyl)-[4-(trifluoromethyl)phenyl]methyl]proline Formula: C19H17BrF3NO2 MolecularWeight: 428.24299

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(C2=CC=C(C=C2)C(F)(F)F)C3=CC(=CC=C3)Br)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(C2=CC=C(C=C2)C(F)(F)F)C3=CC(=CC=C3)Br)C(=O)O

InChI

InChI=1S/C19H17BrF3NO2/c20-15-4-1-3-13(11-15)17(24-10-2-5-16(24)18(25)26)12-6-8-14(9-7-12)19(21,22)23/h1,3-4,6-9,11,16-17H,2,5,10H2,(H,25,26)