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

Systemtic Name: 1-[(2,4-dimethoxyphenyl)-(2-phenylmethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(2-benzyloxyphenyl)-(2,4-dimethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(2,4-dimethoxyphenyl)-(2-phenylmethoxyphenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(2,4-dimethoxyphenyl)-(2-phenylmethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(2-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=CC=C2OCC3=CC=CC=C3)N4CCCC4C(=O)O)OC

Isomeric SMILES

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

InChI

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