(3-cyano-2-cyclohexyl-phenyl)methyl ethaneperoxoate

Systemtic Name: (3-cyano-2-cyclohexyl-phenyl)methyl ethaneperoxoate Openeye Name: (3-cyano-2-cyclohexyl-phenyl)methyl peroxyacetate CAS Name: ethaneperoxoic acid (3-cyano-2-cyclohexylphenyl)methyl ester IUPAC Name: (3-cyano-2-cyclohexylphenyl)methyl ethaneperoxoate Traditional Name: peracetic acid (3-cyano-2-cyclohexyl-benzyl) ester Formula: C16H19NO3 MolecularWeight: 273.32696

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OOCC1=CC=CC(=C1C2CCCCC2)C#N

Isomeric SMILES

CC(=O)OOCC1=CC=CC(=C1C2CCCCC2)C#N

InChI

InChI=1S/C16H19NO3/c1-12(18)20-19-11-15-9-5-8-14(10-17)16(15)13-6-3-2-4-7-13/h5,8-9,13H,2-4,6-7,11H2,1H3