1-[(3,4-dichlorophenyl)-(3,4-diethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(3,4-dichlorophenyl)-(3,4-diethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(3,4-dichlorophenyl)-(3,4-diethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(3,4-dichlorophenyl)-(3,4-diethoxyphenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(3,4-dichlorophenyl)-(3,4-diethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(3,4-dichlorophenyl)-(3,4-diethoxyphenyl)methyl]proline Formula: C22H25Cl2NO4 MolecularWeight: 438.3442

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(C2=CC(=C(C=C2)Cl)Cl)N3CCCC3C(=O)O)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(C2=CC(=C(C=C2)Cl)Cl)N3CCCC3C(=O)O)OCC

InChI

InChI=1S/C22H25Cl2NO4/c1-3-28-19-10-8-15(13-20(19)29-4-2)21(14-7-9-16(23)17(24)12-14)25-11-5-6-18(25)22(26)27/h7-10,12-13,18,21H,3-6,11H2,1-2H3,(H,26,27)