[5-[2,2,2-tris(fluoranyl)ethanoylamino]-4-[2,2,2-tris(fluoranyl)ethanoyloxy]-2,1,3-benzoxadiazol-7-yl] 2,2,2-tris(fluoranyl)ethanoate

Systemtic Name: [5-[2,2,2-tris(fluoranyl)ethanoylamino]-4-[2,2,2-tris(fluoranyl)ethanoyloxy]-2,1,3-benzoxadiazol-7-yl] 2,2,2-tris(fluoranyl)ethanoate Openeye Name: [5-[(2,2,2-trifluoroacetyl)amino]-4-(2,2,2-trifluoroacetyl)oxy-2,1,3-benzoxadiazol-7-yl] 2,2,2-trifluoroacetate CAS Name: 2,2,2-trifluoroacetic acid [4-(2,2,2-trifluoro-1-oxoethoxy)-5-[(2,2,2-trifluoro-1-oxoethyl)amino]-2,1,3-benzoxadiazol-7-yl] ester IUPAC Name: [5-[(2,2,2-trifluoroacetyl)amino]-4-(2,2,2-trifluoroacetyl)oxy-2,1,3-benzoxadiazol-7-yl] 2,2,2-trifluoroacetate Traditional Name: 2,2,2-trifluoroacetic acid [6-[(2,2,2-trifluoroacetyl)amino]-7-(2,2,2-trifluoroacetyl)oxy-benzofurazan-4-yl] ester Formula: C12H2F9N3O6 MolecularWeight: 455.146409

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(C2=NON=C2C(=C1NC(=O)C(F)(F)F)OC(=O)C(F)(F)F)OC(=O)C(F)(F)F

Isomeric SMILES

C1=C(C2=NON=C2C(=C1NC(=O)C(F)(F)F)OC(=O)C(F)(F)F)OC(=O)C(F)(F)F

InChI

InChI=1S/C12H2F9N3O6/c13-10(14,15)7(25)22-2-1-3(28-8(26)11(16,17)18)4-5(24-30-23-4)6(2)29-9(27)12(19,20)21/h1H,(H,22,25)