2,2-dimethyl-5-[[3-(trifluoromethyl)phenyl]methylsulfanylmethylidene]-1,3-dioxane-4,6-dione

Systemtic Name: 2,2-dimethyl-5-[[3-(trifluoromethyl)phenyl]methylsulfanylmethylidene]-1,3-dioxane-4,6-dione Openeye Name: 2,2-dimethyl-5-[[3-(trifluoromethyl)phenyl]methylsulfanylmethylene]-1,3-dioxane-4,6-dione CAS Name: 2,2-dimethyl-5-[[[3-(trifluoromethyl)phenyl]methylthio]methylidene]-1,3-dioxane-4,6-dione IUPAC Name: 2,2-dimethyl-5-[[3-(trifluoromethyl)phenyl]methylsulfanylmethylidene]-1,3-dioxane-4,6-dione Traditional Name: 2,2-dimethyl-5-[[[3-(trifluoromethyl)benzyl]thio]methylene]-1,3-dioxane-4,6-quinone Formula: C15H13F3O4S MolecularWeight: 346.32153

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(=O)C(=CSCC2=CC(=CC=C2)C(F)(F)F)C(=O)O1)C

Isomeric SMILES

CC1(OC(=O)C(=CSCC2=CC(=CC=C2)C(F)(F)F)C(=O)O1)C

InChI

InChI=1S/C15H13F3O4S/c1-14(2)21-12(19)11(13(20)22-14)8-23-7-9-4-3-5-10(6-9)15(16,17)18/h3-6,8H,7H2,1-2H3