(1-cyano-2-methyl-1-phenyl-propyl) ethaneperoxoate

Systemtic Name: (1-cyano-2-methyl-1-phenyl-propyl) ethaneperoxoate Openeye Name: (1-cyano-2-methyl-1-phenyl-propyl) peroxyacetate CAS Name: ethaneperoxoic acid (1-cyano-2-methyl-1-phenylpropyl) ester IUPAC Name: (1-cyano-2-methyl-1-phenylpropyl) ethaneperoxoate Traditional Name: peracetic acid (1-cyano-2-methyl-1-phenyl-propyl) ester Formula: C13H15NO3 MolecularWeight: 233.2631

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C#N)(C1=CC=CC=C1)OOC(=O)C

Isomeric SMILES

CC(C)C(C#N)(C1=CC=CC=C1)OOC(=O)C

InChI

InChI=1S/C13H15NO3/c1-10(2)13(9-14,17-16-11(3)15)12-7-5-4-6-8-12/h4-8,10H,1-3H3