2-ethoxy-3-[4-(1-methylsulfonyloxy-1-phenyl-ethoxy)phenyl]propanoic acid

Systemtic Name: 2-ethoxy-3-[4-(1-methylsulfonyloxy-1-phenyl-ethoxy)phenyl]propanoic acid Openeye Name: 2-ethoxy-3-[4-(1-methylsulfonyloxy-1-phenyl-ethoxy)phenyl]propanoic acid CAS Name: 2-ethoxy-3-[4-(1-methylsulfonyloxy-1-phenylethoxy)phenyl]propanoic acid IUPAC Name: 2-ethoxy-3-[4-(1-methylsulfonyloxy-1-phenylethoxy)phenyl]propanoic acid Traditional Name: 2-ethoxy-3-[4-(1-methylsulfonyloxy-1-phenyl-ethoxy)phenyl]propionic acid Formula: C20H24O7S MolecularWeight: 408.46536

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24O7S/c1-4-25-18(19(21)22)14-15-10-12-17(13-11-15)26-20(2,27-28(3,23)24)16-8-6-5-7-9-16/h5-13,18H,4,14H2,1-3H3,(H,21,22)