[2-(dioxidanyl)-7-oxidanylidene-heptan-3-yl] ethanoate

Systemtic Name: [2-(dioxidanyl)-7-oxidanylidene-heptan-3-yl] ethanoate Openeye Name: [1-(1-hydroperoxyethyl)-5-oxo-pentyl] acetate CAS Name: acetic acid (2-hydroperoxy-7-oxoheptan-3-yl) ester IUPAC Name: (2-hydroperoxy-7-oxoheptan-3-yl) acetate Traditional Name: acetic acid [1-(1-hydroperoxyethyl)-5-keto-pentyl] ester Formula: C9H16O5 MolecularWeight: 204.22034

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CCCC=O)OC(=O)C)OO

Isomeric SMILES

CC(C(CCCC=O)OC(=O)C)OO

InChI

InChI=1S/C9H16O5/c1-7(14-12)9(13-8(2)11)5-3-4-6-10/h6-7,9,12H,3-5H2,1-2H3