1-(5-methylsulfonyl-2-oxidanyl-phenyl)propan-1-one

Systemtic Name: 1-(5-methylsulfonyl-2-oxidanyl-phenyl)propan-1-one Openeye Name: 1-(2-hydroxy-5-methylsulfonyl-phenyl)propan-1-one CAS Name: 1-(2-hydroxy-5-methylsulfonylphenyl)-1-propanone IUPAC Name: 1-(2-hydroxy-5-methylsulfonylphenyl)propan-1-one Traditional Name: 1-(2-hydroxy-5-mesyl-phenyl)propan-1-one Formula: C10H12O4S MolecularWeight: 228.26488

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=C(C=CC(=C1)S(=O)(=O)C)O

Isomeric SMILES

CCC(=O)C1=C(C=CC(=C1)S(=O)(=O)C)O

InChI

InChI=1S/C10H12O4S/c1-3-9(11)8-6-7(15(2,13)14)4-5-10(8)12/h4-6,12H,3H2,1-2H3