4-(2,5-dimethyl-5-oxidanyl-hex-3-yn-2-yl)peroxy-4-oxidanylidene-butanoic acid

Systemtic Name: 4-(2,5-dimethyl-5-oxidanyl-hex-3-yn-2-yl)peroxy-4-oxidanylidene-butanoic acid Openeye Name: 4-(4-hydroxy-1,1,4-trimethyl-pent-2-ynyl)peroxy-4-oxo-butanoic acid CAS Name: 4-(5-hydroxy-2,5-dimethylhex-3-yn-2-yl)dioxy-4-oxobutanoic acid IUPAC Name: 4-(5-hydroxy-2,5-dimethylhex-3-yn-2-yl)peroxy-4-oxobutanoic acid Traditional Name: 4-(4-hydroxy-1,1,4-trimethyl-pent-2-ynyl)peroxy-4-keto-butyric acid Formula: C12H18O6 MolecularWeight: 258.26772

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#CC(C)(C)OOC(=O)CCC(=O)O)O

Isomeric SMILES

CC(C)(C#CC(C)(C)OOC(=O)CCC(=O)O)O

InChI

InChI=1S/C12H18O6/c1-11(2,16)7-8-12(3,4)18-17-10(15)6-5-9(13)14/h16H,5-6H2,1-4H3,(H,13,14)