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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(C2=CC=C(C=C2)OCC3=CC=CC=C3)C4=CC(=CC=C4)C(F)(F)F)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(C2=CC=C(C=C2)OCC3=CC=CC=C3)C4=CC(=CC=C4)C(F)(F)F)C(=O)O

InChI

InChI=1S/C26H24F3NO3/c27-26(28,29)21-9-4-8-20(16-21)24(30-15-5-10-23(30)25(31)32)19-11-13-22(14-12-19)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)