1-[(3,4-dimethoxyphenyl)-(3-ethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(3,4-dimethoxyphenyl)-(3-ethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(3,4-dimethoxyphenyl)-(3-ethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(3,4-dimethoxyphenyl)-(3-ethoxyphenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(3,4-dimethoxyphenyl)-(3-ethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(3,4-dimethoxyphenyl)-m-phenetyl-methyl]proline Formula: C22H27NO5 MolecularWeight: 385.45348

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C(C2=CC(=C(C=C2)OC)OC)N3CCCC3C(=O)O

Isomeric SMILES

CCOC1=CC=CC(=C1)C(C2=CC(=C(C=C2)OC)OC)N3CCCC3C(=O)O

InChI

InChI=1S/C22H27NO5/c1-4-28-17-8-5-7-15(13-17)21(23-12-6-9-18(23)22(24)25)16-10-11-19(26-2)20(14-16)27-3/h5,7-8,10-11,13-14,18,21H,4,6,9,12H2,1-3H3,(H,24,25)