methyl 4-[2-(trichloromethyl)-1,2-oxaziridin-3-yl]benzoate

Systemtic Name: methyl 4-[2-(trichloromethyl)-1,2-oxaziridin-3-yl]benzoate Openeye Name: methyl 4-[2-(trichloromethyl)oxaziridin-3-yl]benzoate CAS Name: 4-[2-(trichloromethyl)-3-oxaziridinyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-(trichloromethyl)oxaziridin-3-yl]benzoate Traditional Name: 4-[2-(trichloromethyl)oxaziridin-3-yl]benzoic acid methyl ester Formula: C10H8Cl3NO3 MolecularWeight: 296.53442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2N(O2)C(Cl)(Cl)Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2N(O2)C(Cl)(Cl)Cl

InChI

InChI=1S/C10H8Cl3NO3/c1-16-9(15)7-4-2-6(3-5-7)8-14(17-8)10(11,12)13/h2-5,8H,1H3