[3-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]oxyphenyl] 2-cyanobutaneperoxoate

Systemtic Name: [3-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]oxyphenyl] 2-cyanobutaneperoxoate Openeye Name: [3-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]oxy]phenyl] 2-cyanobutaneperoxoate CAS Name: 2-cyanobutaneperoxoic acid [3-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]phenyl] ester IUPAC Name: [3-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyphenyl] 2-cyanobutaneperoxoate Traditional Name: 2-cyanoperoxybutyric acid [3-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]oxy]phenyl] ester Formula: C17H12ClF3N2O4 MolecularWeight: 400.73639

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C#N)C(=O)OOC1=CC=CC(=C1)OC2=C(C=C(C=N2)C(F)(F)F)Cl

Isomeric SMILES

CCC(C#N)C(=O)OOC1=CC=CC(=C1)OC2=C(C=C(C=N2)C(F)(F)F)Cl

InChI

InChI=1S/C17H12ClF3N2O4/c1-2-10(8-22)16(24)27-26-13-5-3-4-12(7-13)25-15-14(18)6-11(9-23-15)17(19,20)21/h3-7,9-10H,2H2,1H3