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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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