1-[(2,6-dimethoxyphenyl)-(4-ethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(2,6-dimethoxyphenyl)-(4-ethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(2,6-dimethoxyphenyl)-(4-ethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(2,6-dimethoxyphenyl)-(4-ethoxyphenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(2,6-dimethoxyphenyl)-(4-ethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(2,6-dimethoxyphenyl)-p-phenetyl-methyl]proline Formula: C22H27NO5 MolecularWeight: 385.45348

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(C2=C(C=CC=C2OC)OC)N3CCCC3C(=O)O

Isomeric SMILES

CCOC1=CC=C(C=C1)C(C2=C(C=CC=C2OC)OC)N3CCCC3C(=O)O

InChI

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