1-methylsulfonyl-3-(trifluoromethyloxy)cyclohexa-1,3-diene

Systemtic Name: 1-methylsulfonyl-3-(trifluoromethyloxy)cyclohexa-1,3-diene Openeye Name: 1-methylsulfonyl-3-(trifluoromethoxy)cyclohexa-1,3-diene CAS Name: 1-methylsulfonyl-3-(trifluoromethoxy)cyclohexa-1,3-diene IUPAC Name: 1-methylsulfonyl-3-(trifluoromethoxy)cyclohexa-1,3-diene Traditional Name: 1-mesyl-3-(trifluoromethoxy)cyclohexa-1,3-diene Formula: C8H9F3O3S MolecularWeight: 242.21547

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=CCC1)OC(F)(F)F

Isomeric SMILES

CS(=O)(=O)C1=CC(=CCC1)OC(F)(F)F

InChI

InChI=1S/C8H9F3O3S/c1-15(12,13)7-4-2-3-6(5-7)14-8(9,10)11/h3,5H,2,4H2,1H3