1-[(3-ethoxy-4-phenylmethoxy-phenyl)-pyridin-2-yl-methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(3-ethoxy-4-phenylmethoxy-phenyl)-pyridin-2-yl-methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(4-benzyloxy-3-ethoxy-phenyl)-(2-pyridyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(3-ethoxy-4-phenylmethoxyphenyl)-(2-pyridinyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(3-ethoxy-4-phenylmethoxyphenyl)-pyridin-2-ylmethyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(4-benzoxy-3-ethoxy-phenyl)-(2-pyridyl)methyl]proline Formula: C26H28N2O4 MolecularWeight: 432.51152

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(C2=CC=CC=N2)N3CCCC3C(=O)O)OCC4=CC=CC=C4

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(C2=CC=CC=N2)N3CCCC3C(=O)O)OCC4=CC=CC=C4

InChI

InChI=1S/C26H28N2O4/c1-2-31-24-17-20(13-14-23(24)32-18-19-9-4-3-5-10-19)25(21-11-6-7-15-27-21)28-16-8-12-22(28)26(29)30/h3-7,9-11,13-15,17,22,25H,2,8,12,16,18H2,1H3,(H,29,30)