4-phenylbutyl 2-oxidanylidene-2-phenyl-ethaneperoxoate

Systemtic Name: 4-phenylbutyl 2-oxidanylidene-2-phenyl-ethaneperoxoate Openeye Name: 4-phenylbutyl 2-oxo-2-phenyl-peroxyacetate CAS Name: 2-oxo-2-phenylethaneperoxoic acid 4-phenylbutyl ester IUPAC Name: 4-phenylbutyl 2-oxo-2-phenylethaneperoxoate Traditional Name: 2-keto-2-phenyl-peracetic acid 4-phenylbutyl ester Formula: C18H18O4 MolecularWeight: 298.33312

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCOOC(=O)C(=O)C2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)CCCCOOC(=O)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H18O4/c19-17(16-12-5-2-6-13-16)18(20)22-21-14-8-7-11-15-9-3-1-4-10-15/h1-6,9-10,12-13H,7-8,11,14H2