1-[1-(3,4-diethoxyphenyl)-2-pyridin-2-yl-ethyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[1-(3,4-diethoxyphenyl)-2-pyridin-2-yl-ethyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[1-(3,4-diethoxyphenyl)-2-(2-pyridyl)ethyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[1-(3,4-diethoxyphenyl)-2-(2-pyridinyl)ethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[1-(3,4-diethoxyphenyl)-2-pyridin-2-ylethyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[1-(3,4-diethoxyphenyl)-2-(2-pyridyl)ethyl]proline Formula: C22H28N2O4 MolecularWeight: 384.46872

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28N2O4/c1-3-27-20-11-10-16(14-21(20)28-4-2)19(15-17-8-5-6-12-23-17)24-13-7-9-18(24)22(25)26/h5-6,8,10-12,14,18-19H,3-4,7,9,13,15H2,1-2H3,(H,25,26)