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

Systemtic Name: 1-[(3-phenoxyphenyl)-[3-(trifluoromethyl)phenyl]methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(3-phenoxyphenyl)-[3-(trifluoromethyl)phenyl]methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(3-phenoxyphenyl)-[3-(trifluoromethyl)phenyl]methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(3-phenoxyphenyl)-[3-(trifluoromethyl)phenyl]methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(3-phenoxyphenyl)-[3-(trifluoromethyl)phenyl]methyl]proline Formula: C25H22F3NO3 MolecularWeight: 441.44229

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(C2=CC(=CC=C2)C(F)(F)F)C3=CC(=CC=C3)OC4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(C2=CC(=CC=C2)C(F)(F)F)C3=CC(=CC=C3)OC4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C25H22F3NO3/c26-25(27,28)19-9-4-7-17(15-19)23(29-14-6-13-22(29)24(30)31)18-8-5-12-21(16-18)32-20-10-2-1-3-11-20/h1-5,7-12,15-16,22-23H,6,13-14H2,(H,30,31)