[2-cyano-5-(pyridin-4-ylmethoxy)phenyl] 2-(2-methylphenyl)ethaneperoxoate

Systemtic Name: [2-cyano-5-(pyridin-4-ylmethoxy)phenyl] 2-(2-methylphenyl)ethaneperoxoate Openeye Name: [2-cyano-5-(4-pyridylmethoxy)phenyl] 2-(o-tolyl)peroxyacetate CAS Name: 2-(2-methylphenyl)ethaneperoxoic acid [2-cyano-5-(pyridin-4-ylmethoxy)phenyl] ester IUPAC Name: [2-cyano-5-(pyridin-4-ylmethoxy)phenyl] 2-(2-methylphenyl)ethaneperoxoate Traditional Name: 2-(o-tolyl)peracetic acid [2-cyano-5-(4-pyridylmethoxy)phenyl] ester Formula: C22H18N2O4 MolecularWeight: 374.38932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC(=O)OOC2=C(C=CC(=C2)OCC3=CC=NC=C3)C#N

Isomeric SMILES

CC1=CC=CC=C1CC(=O)OOC2=C(C=CC(=C2)OCC3=CC=NC=C3)C#N

InChI

InChI=1S/C22H18N2O4/c1-16-4-2-3-5-18(16)12-22(25)28-27-21-13-20(7-6-19(21)14-23)26-15-17-8-10-24-11-9-17/h2-11,13H,12,15H2,1H3