5-[(4-tert-butylphenyl)-methylsulfanyl-methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione

Systemtic Name: 5-[(4-tert-butylphenyl)-methylsulfanyl-methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione Openeye Name: 5-[(4-tert-butylphenyl)-methylsulfanyl-methylene]-2,2-dimethyl-1,3-dioxane-4,6-dione CAS Name: 5-[(4-tert-butylphenyl)-(methylthio)methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione IUPAC Name: 5-[(4-tert-butylphenyl)-methylsulfanylmethylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione Traditional Name: 5-[(4-tert-butylphenyl)-(methylthio)methylene]-2,2-dimethyl-1,3-dioxane-4,6-quinone Formula: C18H22O4S MolecularWeight: 334.42988

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(=O)C(=C(C2=CC=C(C=C2)C(C)(C)C)SC)C(=O)O1)C

Isomeric SMILES

CC1(OC(=O)C(=C(C2=CC=C(C=C2)C(C)(C)C)SC)C(=O)O1)C

InChI

InChI=1S/C18H22O4S/c1-17(2,3)12-9-7-11(8-10-12)14(23-6)13-15(19)21-18(4,5)22-16(13)20/h7-10H,1-6H3