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

Systemtic Name: 1-[(3-phenylmethoxyphenyl)-[4-(trifluoromethyl)phenyl]methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(3-benzyloxyphenyl)-[4-(trifluoromethyl)phenyl]methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(3-phenylmethoxyphenyl)-[4-(trifluoromethyl)phenyl]methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(3-phenylmethoxyphenyl)-[4-(trifluoromethyl)phenyl]methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(3-benzoxyphenyl)-[4-(trifluoromethyl)phenyl]methyl]proline Formula: C26H24F3NO3 MolecularWeight: 455.46887

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(C2=CC=C(C=C2)C(F)(F)F)C3=CC(=CC=C3)OCC4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(C2=CC=C(C=C2)C(F)(F)F)C3=CC(=CC=C3)OCC4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C26H24F3NO3/c27-26(28,29)21-13-11-19(12-14-21)24(30-15-5-10-23(30)25(31)32)20-8-4-9-22(16-20)33-17-18-6-2-1-3-7-18/h1-4,6-9,11-14,16,23-24H,5,10,15,17H2,(H,31,32)