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

Systemtic Name: 1-[(2-methylphenyl)-[3-(trifluoromethyl)phenyl]methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[o-tolyl-[3-(trifluoromethyl)phenyl]methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(2-methylphenyl)-[3-(trifluoromethyl)phenyl]methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(2-methylphenyl)-[3-(trifluoromethyl)phenyl]methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[o-tolyl-[3-(trifluoromethyl)phenyl]methyl]proline Formula: C20H20F3NO2 MolecularWeight: 363.37351

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(C2=CC(=CC=C2)C(F)(F)F)N3CCCC3C(=O)O

Isomeric SMILES

CC1=CC=CC=C1C(C2=CC(=CC=C2)C(F)(F)F)N3CCCC3C(=O)O

InChI

InChI=1S/C20H20F3NO2/c1-13-6-2-3-9-16(13)18(24-11-5-10-17(24)19(25)26)14-7-4-8-15(12-14)20(21,22)23/h2-4,6-9,12,17-18H,5,10-11H2,1H3,(H,25,26)