octyl 2-oxidanylidene-2-phenyl-ethaneperoxoate

Systemtic Name: octyl 2-oxidanylidene-2-phenyl-ethaneperoxoate Openeye Name: octyl 2-oxo-2-phenyl-peroxyacetate CAS Name: 2-oxo-2-phenylethaneperoxoic acid octyl ester IUPAC Name: octyl 2-oxo-2-phenylethaneperoxoate Traditional Name: 2-keto-2-phenyl-peracetic acid octyl ester Formula: C16H22O4 MolecularWeight: 278.34348

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOOC(=O)C(=O)C1=CC=CC=C1

Isomeric SMILES

CCCCCCCCOOC(=O)C(=O)C1=CC=CC=C1

InChI

InChI=1S/C16H22O4/c1-2-3-4-5-6-10-13-19-20-16(18)15(17)14-11-8-7-9-12-14/h7-9,11-12H,2-6,10,13H2,1H3