3,3-diethyl-1,4-dioxane-2,5-dione

Systemtic Name: 3,3-diethyl-1,4-dioxane-2,5-dione Openeye Name: 3,3-diethyl-1,4-dioxane-2,5-dione CAS Name: 3,3-diethyl-1,4-dioxane-2,5-dione IUPAC Name: 3,3-diethyl-1,4-dioxane-2,5-dione Traditional Name: 3,3-diethyl-1,4-dioxane-2,5-quinone Formula: C8H12O4 MolecularWeight: 172.17848

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(=O)OCC(=O)O1)CC

Isomeric SMILES

CCC1(C(=O)OCC(=O)O1)CC

InChI

InChI=1S/C8H12O4/c1-3-8(4-2)7(10)11-5-6(9)12-8/h3-5H2,1-2H3