2-[2-methylsulfonyloxy-5-(phenylcarbonyl)phenyl]propanoic acid

Systemtic Name: 2-[2-methylsulfonyloxy-5-(phenylcarbonyl)phenyl]propanoic acid Openeye Name: 2-(5-benzoyl-2-methylsulfonyloxy-phenyl)propanoic acid CAS Name: 2-(5-benzoyl-2-methylsulfonyloxyphenyl)propanoic acid IUPAC Name: 2-(5-benzoyl-2-methylsulfonyloxyphenyl)propanoic acid Traditional Name: 2-(5-benzoyl-2-methylsulfonyloxy-phenyl)propionic acid Formula: C17H16O6S MolecularWeight: 348.37034

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=CC(=C1)C(=O)C2=CC=CC=C2)OS(=O)(=O)C)C(=O)O

Isomeric SMILES

CC(C1=C(C=CC(=C1)C(=O)C2=CC=CC=C2)OS(=O)(=O)C)C(=O)O

InChI

InChI=1S/C17H16O6S/c1-11(17(19)20)14-10-13(8-9-15(14)23-24(2,21)22)16(18)12-6-4-3-5-7-12/h3-11H,1-2H3,(H,19,20)