2,2-dimethyl-5-[1-[1-(4-methylphenyl)sulfonylpyrrol-3-yl]propylidene]-1,3-dioxane-4,6-dione

Systemtic Name: 2,2-dimethyl-5-[1-[1-(4-methylphenyl)sulfonylpyrrol-3-yl]propylidene]-1,3-dioxane-4,6-dione Openeye Name: 2,2-dimethyl-5-[1-[1-(p-tolylsulfonyl)pyrrol-3-yl]propylidene]-1,3-dioxane-4,6-dione CAS Name: 2,2-dimethyl-5-[1-[1-(4-methylphenyl)sulfonyl-3-pyrrolyl]propylidene]-1,3-dioxane-4,6-dione IUPAC Name: 2,2-dimethyl-5-[1-[1-(4-methylphenyl)sulfonylpyrrol-3-yl]propylidene]-1,3-dioxane-4,6-dione Traditional Name: 2,2-dimethyl-5-[1-(1-tosylpyrrol-3-yl)propylidene]-1,3-dioxane-4,6-quinone Formula: C20H21NO6S MolecularWeight: 403.44884

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C1C(=O)OC(OC1=O)(C)C)C2=CN(C=C2)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCC(=C1C(=O)OC(OC1=O)(C)C)C2=CN(C=C2)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C20H21NO6S/c1-5-16(17-18(22)26-20(3,4)27-19(17)23)14-10-11-21(12-14)28(24,25)15-8-6-13(2)7-9-15/h6-12H,5H2,1-4H3