1-[2,6-dinitro-4-(trifluoromethyl)phenyl]-3,5-dimethyl-4-nitro-pyrazole

Systemtic Name: 1-[2,6-dinitro-4-(trifluoromethyl)phenyl]-3,5-dimethyl-4-nitro-pyrazole Openeye Name: 1-[2,6-dinitro-4-(trifluoromethyl)phenyl]-3,5-dimethyl-4-nitro-pyrazole CAS Name: 1-[2,6-dinitro-4-(trifluoromethyl)phenyl]-3,5-dimethyl-4-nitropyrazole IUPAC Name: 1-[2,6-dinitro-4-(trifluoromethyl)phenyl]-3,5-dimethyl-4-nitropyrazole Traditional Name: 1-[2,6-dinitro-4-(trifluoromethyl)phenyl]-3,5-dimethyl-4-nitro-pyrazole Formula: C12H8F3N5O6 MolecularWeight: 375.21703

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=C(C=C(C=C2[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-])C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1C2=C(C=C(C=C2[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-])C)[N+](=O)[O-]

InChI

InChI=1S/C12H8F3N5O6/c1-5-10(20(25)26)6(2)17(16-5)11-8(18(21)22)3-7(12(13,14)15)4-9(11)19(23)24/h3-4H,1-2H3