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

Systemtic Name: 1-[(2,3-dimethoxyphenyl)-(3-ethoxy-4-phenylmethoxy-phenyl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(4-benzyloxy-3-ethoxy-phenyl)-(2,3-dimethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(2,3-dimethoxyphenyl)-(3-ethoxy-4-phenylmethoxyphenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(2,3-dimethoxyphenyl)-(3-ethoxy-4-phenylmethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(4-benzoxy-3-ethoxy-phenyl)-(2,3-dimethoxyphenyl)methyl]proline Formula: C29H33NO6 MolecularWeight: 491.57542

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H33NO6/c1-4-35-26-18-21(15-16-24(26)36-19-20-10-6-5-7-11-20)27(30-17-9-13-23(30)29(31)32)22-12-8-14-25(33-2)28(22)34-3/h5-8,10-12,14-16,18,23,27H,4,9,13,17,19H2,1-3H3,(H,31,32)