(1-cyano-4-methyl-1-phenyl-pentyl) ethaneperoxoate

Systemtic Name: (1-cyano-4-methyl-1-phenyl-pentyl) ethaneperoxoate Openeye Name: (1-cyano-4-methyl-1-phenyl-pentyl) peroxyacetate CAS Name: ethaneperoxoic acid (1-cyano-4-methyl-1-phenylpentyl) ester IUPAC Name: (1-cyano-4-methyl-1-phenylpentyl) ethaneperoxoate Traditional Name: peracetic acid (1-cyano-4-methyl-1-phenyl-pentyl) ester Formula: C15H19NO3 MolecularWeight: 261.31626

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19NO3/c1-12(2)9-10-15(11-16,19-18-13(3)17)14-7-5-4-6-8-14/h4-8,12H,9-10H2,1-3H3