[1-bromanyloxy-3,4,5-tris(ethanoylperoxy)-6-oxidanylidene-hexan-2-yl] ethaneperoxoate

Systemtic Name: [1-bromanyloxy-3,4,5-tris(ethanoylperoxy)-6-oxidanylidene-hexan-2-yl] ethaneperoxoate Openeye Name: [2,3,4-tris(acetylperoxy)-1-(bromooxymethyl)-5-oxo-pentyl] peroxyacetate CAS Name: ethaneperoxoic acid [3,4,5-tris(acetyldioxy)-1-bromooxy-6-oxohexan-2-yl] ester IUPAC Name: [3,4,5-tris(acetylperoxy)-1-bromooxy-6-oxohexan-2-yl] ethaneperoxoate Traditional Name: peracetic acid [2,3,4-tris(acetylperoxy)-1-(bromooxymethyl)-5-keto-pentyl] ester Formula: C14H19BrO14 MolecularWeight: 491.19626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OOC(COBr)C(C(C(C=O)OOC(=O)C)OOC(=O)C)OOC(=O)C

Isomeric SMILES

CC(=O)OOC(COBr)C(C(C(C=O)OOC(=O)C)OOC(=O)C)OOC(=O)C

InChI

InChI=1S/C14H19BrO14/c1-7(17)22-26-11(5-16)13(28-24-9(3)19)14(29-25-10(4)20)12(6-21-15)27-23-8(2)18/h5,11-14H,6H2,1-4H3