1-[[4-(trifluoromethyl)phenyl]methylsulfonyl]propan-2-one

Systemtic Name: 1-[[4-(trifluoromethyl)phenyl]methylsulfonyl]propan-2-one Openeye Name: 1-[[4-(trifluoromethyl)phenyl]methylsulfonyl]propan-2-one CAS Name: 1-[[4-(trifluoromethyl)phenyl]methylsulfonyl]-2-propanone IUPAC Name: 1-[[4-(trifluoromethyl)phenyl]methylsulfonyl]propan-2-one Traditional Name: 1-[4-(trifluoromethyl)benzyl]sulfonylacetone Formula: C11H11F3O3S MolecularWeight: 280.26345

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CS(=O)(=O)CC1=CC=C(C=C1)C(F)(F)F

Isomeric SMILES

CC(=O)CS(=O)(=O)CC1=CC=C(C=C1)C(F)(F)F

InChI

InChI=1S/C11H11F3O3S/c1-8(15)6-18(16,17)7-9-2-4-10(5-3-9)11(12,13)14/h2-5H,6-7H2,1H3