2-(4-methyl-2-nitro-phenoxy)-N-[2,2,2-tris(fluoranyl)ethylcarbamoyl]ethanamide

Systemtic Name: 2-(4-methyl-2-nitro-phenoxy)-N-[2,2,2-tris(fluoranyl)ethylcarbamoyl]ethanamide Openeye Name: 2-(4-methyl-2-nitro-phenoxy)-N-(2,2,2-trifluoroethylcarbamoyl)acetamide CAS Name: 2-(4-methyl-2-nitrophenoxy)-N-[oxo-(2,2,2-trifluoroethylamino)methyl]acetamide IUPAC Name: 2-(4-methyl-2-nitrophenoxy)-N-(2,2,2-trifluoroethylcarbamoyl)acetamide Traditional Name: 2-(4-methyl-2-nitro-phenoxy)-N-(2,2,2-trifluoroethylcarbamoyl)acetamide Formula: C12H12F3N3O5 MolecularWeight: 335.23599

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC(=O)NC(=O)NCC(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)OCC(=O)NC(=O)NCC(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C12H12F3N3O5/c1-7-2-3-9(8(4-7)18(21)22)23-5-10(19)17-11(20)16-6-12(13,14)15/h2-4H,5-6H2,1H3,(H2,16,17,19,20)