2-ethoxy-2-[3-[2-(4-methylsulfonyloxyphenyl)ethoxy]-4-(phenylmethyl)phenyl]propanoic acid

Systemtic Name: 2-ethoxy-2-[3-[2-(4-methylsulfonyloxyphenyl)ethoxy]-4-(phenylmethyl)phenyl]propanoic acid Openeye Name: 2-[4-benzyl-3-[2-(4-methylsulfonyloxyphenyl)ethoxy]phenyl]-2-ethoxy-propanoic acid CAS Name: 2-ethoxy-2-[3-[2-(4-methylsulfonyloxyphenyl)ethoxy]-4-(phenylmethyl)phenyl]propanoic acid IUPAC Name: 2-[4-benzyl-3-[2-(4-methylsulfonyloxyphenyl)ethoxy]phenyl]-2-ethoxypropanoic acid Traditional Name: 2-[4-benzyl-3-[2-(4-methylsulfonyloxyphenyl)ethoxy]phenyl]-2-ethoxy-propionic acid Formula: C27H30O7S MolecularWeight: 498.5879

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C)(C1=CC(=C(C=C1)CC2=CC=CC=C2)OCCC3=CC=C(C=C3)OS(=O)(=O)C)C(=O)O

Isomeric SMILES

CCOC(C)(C1=CC(=C(C=C1)CC2=CC=CC=C2)OCCC3=CC=C(C=C3)OS(=O)(=O)C)C(=O)O

InChI

InChI=1S/C27H30O7S/c1-4-33-27(2,26(28)29)23-13-12-22(18-21-8-6-5-7-9-21)25(19-23)32-17-16-20-10-14-24(15-11-20)34-35(3,30)31/h5-15,19H,4,16-18H2,1-3H3,(H,28,29)