1-[(3,4-dichlorophenyl)-(3-methoxy-4-phenylmethoxy-phenyl)methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(3,4-dichlorophenyl)-(3-methoxy-4-phenylmethoxy-phenyl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(4-benzyloxy-3-methoxy-phenyl)-(3,4-dichlorophenyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(3,4-dichlorophenyl)-(3-methoxy-4-phenylmethoxyphenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(3,4-dichlorophenyl)-(3-methoxy-4-phenylmethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(4-benzoxy-3-methoxy-phenyl)-(3,4-dichlorophenyl)methyl]proline Formula: C26H25Cl2NO4 MolecularWeight: 486.387

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(C2=CC(=C(C=C2)Cl)Cl)N3CCCC3C(=O)O)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)C(C2=CC(=C(C=C2)Cl)Cl)N3CCCC3C(=O)O)OCC4=CC=CC=C4

InChI

InChI=1S/C26H25Cl2NO4/c1-32-24-15-19(10-12-23(24)33-16-17-6-3-2-4-7-17)25(18-9-11-20(27)21(28)14-18)29-13-5-8-22(29)26(30)31/h2-4,6-7,9-12,14-15,22,25H,5,8,13,16H2,1H3,(H,30,31)