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

Systemtic Name: 1-[(3-methoxy-4-phenylmethoxy-phenyl)-pyridin-3-yl-methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(4-benzyloxy-3-methoxy-phenyl)-(3-pyridyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(3-methoxy-4-phenylmethoxyphenyl)-(3-pyridinyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(3-methoxy-4-phenylmethoxyphenyl)-pyridin-3-ylmethyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(4-benzoxy-3-methoxy-phenyl)-(3-pyridyl)methyl]proline Formula: C25H26N2O4 MolecularWeight: 418.48494

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(C2=CN=CC=C2)N3CCCC3C(=O)O)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)C(C2=CN=CC=C2)N3CCCC3C(=O)O)OCC4=CC=CC=C4

InChI

InChI=1S/C25H26N2O4/c1-30-23-15-19(11-12-22(23)31-17-18-7-3-2-4-8-18)24(20-9-5-13-26-16-20)27-14-6-10-21(27)25(28)29/h2-5,7-9,11-13,15-16,21,24H,6,10,14,17H2,1H3,(H,28,29)