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

Systemtic Name: 1-[(3-methoxy-4-phenylmethoxy-phenyl)-[3-(trifluoromethyl)phenyl]methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(4-benzyloxy-3-methoxy-phenyl)-[3-(trifluoromethyl)phenyl]methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(3-methoxy-4-phenylmethoxyphenyl)-[3-(trifluoromethyl)phenyl]methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(3-methoxy-4-phenylmethoxyphenyl)-[3-(trifluoromethyl)phenyl]methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(4-benzoxy-3-methoxy-phenyl)-[3-(trifluoromethyl)phenyl]methyl]proline Formula: C27H26F3NO4 MolecularWeight: 485.49485

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(C2=CC(=CC=C2)C(F)(F)F)N3CCCC3C(=O)O)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)C(C2=CC(=CC=C2)C(F)(F)F)N3CCCC3C(=O)O)OCC4=CC=CC=C4

InChI

InChI=1S/C27H26F3NO4/c1-34-24-16-20(12-13-23(24)35-17-18-7-3-2-4-8-18)25(31-14-6-11-22(31)26(32)33)19-9-5-10-21(15-19)27(28,29)30/h2-5,7-10,12-13,15-16,22,25H,6,11,14,17H2,1H3,(H,32,33)