3-(3-cyclopentyloxy-4-methoxy-phenyl)sulfonyl-3-[3-(4-methoxyphenoxy)phenyl]propanoic acid

Systemtic Name: 3-(3-cyclopentyloxy-4-methoxy-phenyl)sulfonyl-3-[3-(4-methoxyphenoxy)phenyl]propanoic acid Openeye Name: 3-[3-(cyclopentoxy)-4-methoxy-phenyl]sulfonyl-3-[3-(4-methoxyphenoxy)phenyl]propanoic acid CAS Name: 3-(3-cyclopentyloxy-4-methoxyphenyl)sulfonyl-3-[3-(4-methoxyphenoxy)phenyl]propanoic acid IUPAC Name: 3-(3-cyclopentyloxy-4-methoxyphenyl)sulfonyl-3-[3-(4-methoxyphenoxy)phenyl]propanoic acid Traditional Name: 3-[3-(cyclopentoxy)-4-methoxy-phenyl]sulfonyl-3-[3-(4-methoxyphenoxy)phenyl]propionic acid Formula: C28H30O8S MolecularWeight: 526.598

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OC2=CC=CC(=C2)C(CC(=O)O)S(=O)(=O)C3=CC(=C(C=C3)OC)OC4CCCC4

Isomeric SMILES

COC1=CC=C(C=C1)OC2=CC=CC(=C2)C(CC(=O)O)S(=O)(=O)C3=CC(=C(C=C3)OC)OC4CCCC4

InChI

InChI=1S/C28H30O8S/c1-33-20-10-12-22(13-11-20)35-23-9-5-6-19(16-23)27(18-28(29)30)37(31,32)24-14-15-25(34-2)26(17-24)36-21-7-3-4-8-21/h5-6,9-17,21,27H,3-4,7-8,18H2,1-2H3,(H,29,30)