2-[4-[2-(2-ethylhexoxy)-2-oxidanylidene-ethanoyl]oxy-2-methyl-pentan-2-yl]peroxy-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[4-[2-(2-ethylhexoxy)-2-oxidanylidene-ethanoyl]oxy-2-methyl-pentan-2-yl]peroxy-2-oxidanylidene-ethanoic acid Openeye Name: 2-[3-[2-(2-ethylhexoxy)-2-oxo-acetyl]oxy-1,1-dimethyl-butyl]peroxy-2-oxo-acetic acid CAS Name: 2-[4-[2-(2-ethylhexoxy)-1,2-dioxoethoxy]-2-methylpentan-2-yl]dioxy-2-oxoacetic acid IUPAC Name: 2-[4-[2-(2-ethylhexoxy)-2-oxoacetyl]oxy-2-methylpentan-2-yl]peroxy-2-oxoacetic acid Traditional Name: 2-[3-[2-(2-ethylhexoxy)-2-keto-acetyl]oxy-1,1-dimethyl-butyl]peroxy-2-keto-acetic acid Formula: C18H30O9 MolecularWeight: 390.4254

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC(=O)C(=O)OC(C)CC(C)(C)OOC(=O)C(=O)O

Isomeric SMILES

CCCCC(CC)COC(=O)C(=O)OC(C)CC(C)(C)OOC(=O)C(=O)O

InChI

InChI=1S/C18H30O9/c1-6-8-9-13(7-2)11-24-16(22)17(23)25-12(3)10-18(4,5)27-26-15(21)14(19)20/h12-13H,6-11H2,1-5H3,(H,19,20)