6-methyl-4-(trifluoromethylsulfonylmethyl)chromen-2-one

Systemtic Name: 6-methyl-4-(trifluoromethylsulfonylmethyl)chromen-2-one Openeye Name: 6-methyl-4-(trifluoromethylsulfonylmethyl)chromen-2-one CAS Name: 6-methyl-4-(trifluoromethylsulfonylmethyl)-1-benzopyran-2-one IUPAC Name: 6-methyl-4-(trifluoromethylsulfonylmethyl)chromen-2-one Traditional Name: 6-methyl-4-(triflylmethyl)coumarin Formula: C12H9F3O4S MolecularWeight: 306.25767

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(=O)C=C2CS(=O)(=O)C(F)(F)F

Isomeric SMILES

CC1=CC2=C(C=C1)OC(=O)C=C2CS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C12H9F3O4S/c1-7-2-3-10-9(4-7)8(5-11(16)19-10)6-20(17,18)12(13,14)15/h2-5H,6H2,1H3