1-[(2,4-dimethoxyphenyl)-(4-phenylmethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(2,4-dimethoxyphenyl)-(4-phenylmethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(4-benzyloxyphenyl)-(2,4-dimethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(2,4-dimethoxyphenyl)-(4-phenylmethoxyphenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(2,4-dimethoxyphenyl)-(4-phenylmethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(4-benzoxyphenyl)-(2,4-dimethoxyphenyl)methyl]proline Formula: C27H29NO5 MolecularWeight: 447.52286

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(C2=CC=C(C=C2)OCC3=CC=CC=C3)N4CCCC4C(=O)O)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C(C2=CC=C(C=C2)OCC3=CC=CC=C3)N4CCCC4C(=O)O)OC

InChI

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