2-(4-bromanyl-5-methyl-3-nitro-pyrazol-1-yl)-N-(2-cyano-4-nitro-phenyl)ethanamide

Systemtic Name: 2-(4-bromanyl-5-methyl-3-nitro-pyrazol-1-yl)-N-(2-cyano-4-nitro-phenyl)ethanamide Openeye Name: 2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)-N-(2-cyano-4-nitro-phenyl)acetamide CAS Name: 2-(4-bromo-5-methyl-3-nitro-1-pyrazolyl)-N-(2-cyano-4-nitrophenyl)acetamide IUPAC Name: 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-(2-cyano-4-nitrophenyl)acetamide Traditional Name: 2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)-N-(2-cyano-4-nitro-phenyl)acetamide Formula: C13H9BrN6O5 MolecularWeight: 409.15176

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C#N)[N+](=O)[O-])Br

Isomeric SMILES

CC1=C(C(=NN1CC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C#N)[N+](=O)[O-])Br

InChI

InChI=1S/C13H9BrN6O5/c1-7-12(14)13(20(24)25)17-18(7)6-11(21)16-10-3-2-9(19(22)23)4-8(10)5-15/h2-4H,6H2,1H3,(H,16,21)