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

Systemtic Name: 2-(4-bromanyl-5-methyl-3-nitro-pyrazol-1-yl)-N-(5-nitro-2-oxidanyl-phenyl)ethanamide Openeye Name: 2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)-N-(2-hydroxy-5-nitro-phenyl)acetamide CAS Name: 2-(4-bromo-5-methyl-3-nitro-1-pyrazolyl)-N-(2-hydroxy-5-nitrophenyl)acetamide IUPAC Name: 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-(2-hydroxy-5-nitrophenyl)acetamide Traditional Name: 2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)-N-(2-hydroxy-5-nitro-phenyl)acetamide Formula: C12H10BrN5O6 MolecularWeight: 400.1417

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H10BrN5O6/c1-6-11(13)12(18(23)24)15-16(6)5-10(20)14-8-4-7(17(21)22)2-3-9(8)19/h2-4,19H,5H2,1H3,(H,14,20)