1-[(5-chloranyl-2-methoxy-phenyl)-(3,5-dimethoxy-4-phenylmethoxy-phenyl)methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(5-chloranyl-2-methoxy-phenyl)-(3,5-dimethoxy-4-phenylmethoxy-phenyl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(4-benzyloxy-3,5-dimethoxy-phenyl)-(5-chloro-2-methoxy-phenyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(5-chloro-2-methoxyphenyl)-(3,5-dimethoxy-4-phenylmethoxyphenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(5-chloro-2-methoxyphenyl)-(3,5-dimethoxy-4-phenylmethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(4-benzoxy-3,5-dimethoxy-phenyl)-(5-chloro-2-methoxy-phenyl)methyl]proline Formula: C28H30ClNO6 MolecularWeight: 511.9939

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)C(C2=CC(=C(C(=C2)OC)OCC3=CC=CC=C3)OC)N4CCCC4C(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)C(C2=CC(=C(C(=C2)OC)OCC3=CC=CC=C3)OC)N4CCCC4C(=O)O

InChI

InChI=1S/C28H30ClNO6/c1-33-23-12-11-20(29)16-21(23)26(30-13-7-10-22(30)28(31)32)19-14-24(34-2)27(25(15-19)35-3)36-17-18-8-5-4-6-9-18/h4-6,8-9,11-12,14-16,22,26H,7,10,13,17H2,1-3H3,(H,31,32)