5-(furan-2-ylmethylsulfanylmethylidene)-2,2-dimethyl-1,3-dioxane-4,6-dione

Systemtic Name: 5-(furan-2-ylmethylsulfanylmethylidene)-2,2-dimethyl-1,3-dioxane-4,6-dione Openeye Name: 5-(2-furylmethylsulfanylmethylene)-2,2-dimethyl-1,3-dioxane-4,6-dione CAS Name: 5-[(2-furanylmethylthio)methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione IUPAC Name: 5-(furan-2-ylmethylsulfanylmethylidene)-2,2-dimethyl-1,3-dioxane-4,6-dione Traditional Name: 5-[(2-furfurylthio)methylene]-2,2-dimethyl-1,3-dioxane-4,6-quinone Formula: C12H12O5S MolecularWeight: 268.28568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(=O)C(=CSCC2=CC=CO2)C(=O)O1)C

Isomeric SMILES

CC1(OC(=O)C(=CSCC2=CC=CO2)C(=O)O1)C

InChI

InChI=1S/C12H12O5S/c1-12(2)16-10(13)9(11(14)17-12)7-18-6-8-4-3-5-15-8/h3-5,7H,6H2,1-2H3