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

Systemtic Name: 1-[(3-ethoxyphenyl)-[2-(trifluoromethyl)phenyl]methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(3-ethoxyphenyl)-[2-(trifluoromethyl)phenyl]methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(3-ethoxyphenyl)-[2-(trifluoromethyl)phenyl]methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(3-ethoxyphenyl)-[2-(trifluoromethyl)phenyl]methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[m-phenetyl-[2-(trifluoromethyl)phenyl]methyl]proline Formula: C21H22F3NO3 MolecularWeight: 393.39949

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C(C2=CC=CC=C2C(F)(F)F)N3CCCC3C(=O)O

Isomeric SMILES

CCOC1=CC=CC(=C1)C(C2=CC=CC=C2C(F)(F)F)N3CCCC3C(=O)O

InChI

InChI=1S/C21H22F3NO3/c1-2-28-15-8-5-7-14(13-15)19(25-12-6-11-18(25)20(26)27)16-9-3-4-10-17(16)21(22,23)24/h3-5,7-10,13,18-19H,2,6,11-12H2,1H3,(H,26,27)