1-[(2,6-dimethoxyphenyl)-(3-phenoxyphenyl)methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(2,6-dimethoxyphenyl)-(3-phenoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(2,6-dimethoxyphenyl)-(3-phenoxyphenyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(2,6-dimethoxyphenyl)-(3-phenoxyphenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(2,6-dimethoxyphenyl)-(3-phenoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(2,6-dimethoxyphenyl)-(3-phenoxyphenyl)methyl]proline Formula: C26H27NO5 MolecularWeight: 433.49628

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OC)C(C2=CC(=CC=C2)OC3=CC=CC=C3)N4CCCC4C(=O)O

Isomeric SMILES

COC1=C(C(=CC=C1)OC)C(C2=CC(=CC=C2)OC3=CC=CC=C3)N4CCCC4C(=O)O

InChI

InChI=1S/C26H27NO5/c1-30-22-14-7-15-23(31-2)24(22)25(27-16-8-13-21(27)26(28)29)18-9-6-12-20(17-18)32-19-10-4-3-5-11-19/h3-7,9-12,14-15,17,21,25H,8,13,16H2,1-2H3,(H,28,29)