5-(dioxidanylmethyl)-3,6-diethynyl-1,4-dioxane-2-carboxylic acid

Systemtic Name: 5-(dioxidanylmethyl)-3,6-diethynyl-1,4-dioxane-2-carboxylic acid Openeye Name: 3,6-diethynyl-5-(hydroperoxymethyl)-1,4-dioxane-2-carboxylic acid CAS Name: 3,6-diethynyl-5-(hydroperoxymethyl)-1,4-dioxane-2-carboxylic acid IUPAC Name: 3,6-diethynyl-5-(hydroperoxymethyl)-1,4-dioxane-2-carboxylic acid Traditional Name: 3,6-diethynyl-5-(hydroperoxymethyl)-1,4-dioxane-2-carboxylic acid Formula: C10H10O6 MolecularWeight: 226.1828

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1C(OC(C(O1)C(=O)O)C#C)COO

Isomeric SMILES

C#CC1C(OC(C(O1)C(=O)O)C#C)COO

InChI

InChI=1S/C10H10O6/c1-3-6-8(5-14-13)15-7(4-2)9(16-6)10(11)12/h1-2,6-9,13H,5H2,(H,11,12)