1-[(2,6-dimethoxyphenyl)-(2-phenylmethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(2,6-dimethoxyphenyl)-(2-phenylmethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(2-benzyloxyphenyl)-(2,6-dimethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(2,6-dimethoxyphenyl)-(2-phenylmethoxyphenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(2,6-dimethoxyphenyl)-(2-phenylmethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(2-benzoxyphenyl)-(2,6-dimethoxyphenyl)methyl]proline Formula: C27H29NO5 MolecularWeight: 447.52286

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OC)C(C2=CC=CC=C2OCC3=CC=CC=C3)N4CCCC4C(=O)O

Isomeric SMILES

COC1=C(C(=CC=C1)OC)C(C2=CC=CC=C2OCC3=CC=CC=C3)N4CCCC4C(=O)O

InChI

InChI=1S/C27H29NO5/c1-31-23-15-8-16-24(32-2)25(23)26(28-17-9-13-21(28)27(29)30)20-12-6-7-14-22(20)33-18-19-10-4-3-5-11-19/h3-8,10-12,14-16,21,26H,9,13,17-18H2,1-2H3,(H,29,30)