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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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