2-ethoxy-3-[4-[2-(3-methoxy-4-methylsulfonyloxy-phenyl)ethoxy]phenyl]propanoic acid

Systemtic Name: 2-ethoxy-3-[4-[2-(3-methoxy-4-methylsulfonyloxy-phenyl)ethoxy]phenyl]propanoic acid Openeye Name: 2-ethoxy-3-[4-[2-(3-methoxy-4-methylsulfonyloxy-phenyl)ethoxy]phenyl]propanoic acid CAS Name: 2-ethoxy-3-[4-[2-(3-methoxy-4-methylsulfonyloxyphenyl)ethoxy]phenyl]propanoic acid IUPAC Name: 2-ethoxy-3-[4-[2-(3-methoxy-4-methylsulfonyloxyphenyl)ethoxy]phenyl]propanoic acid Traditional Name: 2-ethoxy-3-[4-[2-(3-methoxy-4-methylsulfonyloxy-phenyl)ethoxy]phenyl]propionic acid Formula: C21H26O8S MolecularWeight: 438.49134

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC1=CC=C(C=C1)OCCC2=CC(=C(C=C2)OS(=O)(=O)C)OC)C(=O)O

Isomeric SMILES

CCOC(CC1=CC=C(C=C1)OCCC2=CC(=C(C=C2)OS(=O)(=O)C)OC)C(=O)O

InChI

InChI=1S/C21H26O8S/c1-4-27-20(21(22)23)14-15-5-8-17(9-6-15)28-12-11-16-7-10-18(19(13-16)26-2)29-30(3,24)25/h5-10,13,20H,4,11-12,14H2,1-3H3,(H,22,23)