1-[(2,6-dimethoxyphenyl)-(4-ethoxy-3-methoxy-phenyl)methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(2,6-dimethoxyphenyl)-(4-ethoxy-3-methoxy-phenyl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(2,6-dimethoxyphenyl)-(4-ethoxy-3-methoxy-phenyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(2,6-dimethoxyphenyl)-(4-ethoxy-3-methoxyphenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(2,6-dimethoxyphenyl)-(4-ethoxy-3-methoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(2,6-dimethoxyphenyl)-(4-ethoxy-3-methoxy-phenyl)methyl]proline Formula: C23H29NO6 MolecularWeight: 415.47946

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(C2=C(C=CC=C2OC)OC)N3CCCC3C(=O)O)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(C2=C(C=CC=C2OC)OC)N3CCCC3C(=O)O)OC

InChI

InChI=1S/C23H29NO6/c1-5-30-17-12-11-15(14-20(17)29-4)22(24-13-7-8-16(24)23(25)26)21-18(27-2)9-6-10-19(21)28-3/h6,9-12,14,16,22H,5,7-8,13H2,1-4H3,(H,25,26)