1-[(3-ethoxy-4-phenylmethoxy-phenyl)-(2-methoxyphenyl)methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(3-ethoxy-4-phenylmethoxy-phenyl)-(2-methoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(4-benzyloxy-3-ethoxy-phenyl)-(2-methoxyphenyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(3-ethoxy-4-phenylmethoxyphenyl)-(2-methoxyphenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(3-ethoxy-4-phenylmethoxyphenyl)-(2-methoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(4-benzoxy-3-ethoxy-phenyl)-(2-methoxyphenyl)methyl]proline Formula: C28H31NO5 MolecularWeight: 461.54944

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(C2=CC=CC=C2OC)N3CCCC3C(=O)O)OCC4=CC=CC=C4

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(C2=CC=CC=C2OC)N3CCCC3C(=O)O)OCC4=CC=CC=C4

InChI

InChI=1S/C28H31NO5/c1-3-33-26-18-21(15-16-25(26)34-19-20-10-5-4-6-11-20)27(22-12-7-8-14-24(22)32-2)29-17-9-13-23(29)28(30)31/h4-8,10-12,14-16,18,23,27H,3,9,13,17,19H2,1-2H3,(H,30,31)