2-[5-ethyl-4-[3-[3-(2-methoxycarbonylphenoxy)-2-propyl-phenoxy]propoxy]-2-oxidanyl-phenyl]pyrrolidine-1-carboxylic acid

Systemtic Name: 2-[5-ethyl-4-[3-[3-(2-methoxycarbonylphenoxy)-2-propyl-phenoxy]propoxy]-2-oxidanyl-phenyl]pyrrolidine-1-carboxylic acid Openeye Name: 2-[5-ethyl-2-hydroxy-4-[3-[3-(2-methoxycarbonylphenoxy)-2-propyl-phenoxy]propoxy]phenyl]pyrrolidine-1-carboxylic acid CAS Name: 2-[5-ethyl-2-hydroxy-4-[3-[3-(2-methoxycarbonylphenoxy)-2-propylphenoxy]propoxy]phenyl]-1-pyrrolidinecarboxylic acid IUPAC Name: 2-[5-ethyl-2-hydroxy-4-[3-[3-(2-methoxycarbonylphenoxy)-2-propylphenoxy]propoxy]phenyl]pyrrolidine-1-carboxylic acid Traditional Name: 2-[4-[3-[3-(2-carbomethoxyphenoxy)-2-propyl-phenoxy]propoxy]-5-ethyl-2-hydroxy-phenyl]pyrrolidine-1-carboxylic acid Formula: C33H39NO8 MolecularWeight: 577.66466

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC=C1OCCCOC2=C(C=C(C(=C2)O)C3CCCN3C(=O)O)CC)OC4=CC=CC=C4C(=O)OC

Isomeric SMILES

CCCC1=C(C=CC=C1OCCCOC2=C(C=C(C(=C2)O)C3CCCN3C(=O)O)CC)OC4=CC=CC=C4C(=O)OC

InChI

InChI=1S/C33H39NO8/c1-4-11-23-28(15-8-16-29(23)42-30-14-7-6-12-24(30)32(36)39-3)40-18-10-19-41-31-21-27(35)25(20-22(31)5-2)26-13-9-17-34(26)33(37)38/h6-8,12,14-16,20-21,26,35H,4-5,9-11,13,17-19H2,1-3H3,(H,37,38)