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

Systemtic Name: 1-[1-(4-ethoxy-3-methoxy-phenyl)-2-pyridin-2-yl-ethyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[1-(4-ethoxy-3-methoxy-phenyl)-2-(2-pyridyl)ethyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[1-(4-ethoxy-3-methoxyphenyl)-2-(2-pyridinyl)ethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[1-(4-ethoxy-3-methoxyphenyl)-2-pyridin-2-ylethyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[1-(4-ethoxy-3-methoxy-phenyl)-2-(2-pyridyl)ethyl]proline Formula: C21H26N2O4 MolecularWeight: 370.44214

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(CC2=CC=CC=N2)N3CCCC3C(=O)O)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(CC2=CC=CC=N2)N3CCCC3C(=O)O)OC

InChI

InChI=1S/C21H26N2O4/c1-3-27-19-10-9-15(13-20(19)26-2)18(14-16-7-4-5-11-22-16)23-12-6-8-17(23)21(24)25/h4-5,7,9-11,13,17-18H,3,6,8,12,14H2,1-2H3,(H,24,25)