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

Systemtic Name: 1-[(2,4-dichlorophenyl)-(3,4-dimethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(2,4-dichlorophenyl)-(3,4-dimethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(2,4-dichlorophenyl)-(3,4-dimethoxyphenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(2,4-dichlorophenyl)-(3,4-dimethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(2,4-dichlorophenyl)-(3,4-dimethoxyphenyl)methyl]proline Formula: C20H21Cl2NO4 MolecularWeight: 410.29104

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(C2=C(C=C(C=C2)Cl)Cl)N3CCCC3C(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(C2=C(C=C(C=C2)Cl)Cl)N3CCCC3C(=O)O)OC

InChI

InChI=1S/C20H21Cl2NO4/c1-26-17-8-5-12(10-18(17)27-2)19(14-7-6-13(21)11-15(14)22)23-9-3-4-16(23)20(24)25/h5-8,10-11,16,19H,3-4,9H2,1-2H3,(H,24,25)