N-[2,6-bis(bromanyl)-4-nitro-phenyl]-2-(5-methyl-3,4-dinitro-pyrazol-1-yl)ethanamide

Systemtic Name: N-[2,6-bis(bromanyl)-4-nitro-phenyl]-2-(5-methyl-3,4-dinitro-pyrazol-1-yl)ethanamide Openeye Name: N-(2,6-dibromo-4-nitro-phenyl)-2-(5-methyl-3,4-dinitro-pyrazol-1-yl)acetamide CAS Name: N-(2,6-dibromo-4-nitrophenyl)-2-(5-methyl-3,4-dinitro-1-pyrazolyl)acetamide IUPAC Name: N-(2,6-dibromo-4-nitrophenyl)-2-(5-methyl-3,4-dinitropyrazol-1-yl)acetamide Traditional Name: N-(2,6-dibromo-4-nitro-phenyl)-2-(5-methyl-3,4-dinitro-pyrazol-1-yl)acetamide Formula: C12H8Br2N6O7 MolecularWeight: 508.03592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NC2=C(C=C(C=C2Br)[N+](=O)[O-])Br)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC(=O)NC2=C(C=C(C=C2Br)[N+](=O)[O-])Br)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H8Br2N6O7/c1-5-11(19(24)25)12(20(26)27)16-17(5)4-9(21)15-10-7(13)2-6(18(22)23)3-8(10)14/h2-3H,4H2,1H3,(H,15,21)