N-[3-[2,2-bis(fluoranyl)ethoxy]-5-nitro-phenyl]-3-nitro-1H-pyrazole-5-carboxamide

Systemtic Name: N-[3-[2,2-bis(fluoranyl)ethoxy]-5-nitro-phenyl]-3-nitro-1H-pyrazole-5-carboxamide Openeye Name: N-[3-(2,2-difluoroethoxy)-5-nitro-phenyl]-3-nitro-1H-pyrazole-5-carboxamide CAS Name: N-[3-(2,2-difluoroethoxy)-5-nitrophenyl]-3-nitro-1H-pyrazole-5-carboxamide IUPAC Name: N-[3-(2,2-difluoroethoxy)-5-nitrophenyl]-3-nitro-1H-pyrazole-5-carboxamide Traditional Name: N-[3-(2,2-difluoroethoxy)-5-nitro-phenyl]-3-nitro-1H-pyrazole-5-carboxamide Formula: C12H9F2N5O6 MolecularWeight: 357.226566

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1[N+](=O)[O-])OCC(F)F)NC(=O)C2=CC(=NN2)[N+](=O)[O-]

Isomeric SMILES

C1=C(C=C(C=C1[N+](=O)[O-])OCC(F)F)NC(=O)C2=CC(=NN2)[N+](=O)[O-]

InChI

InChI=1S/C12H9F2N5O6/c13-10(14)5-25-8-2-6(1-7(3-8)18(21)22)15-12(20)9-4-11(17-16-9)19(23)24/h1-4,10H,5H2,(H,15,20)(H,16,17)