1,5-dimethyl-4-nitro-N-(5-nitro-2-oxidanyl-phenyl)pyrazole-3-carboxamide

Systemtic Name: 1,5-dimethyl-4-nitro-N-(5-nitro-2-oxidanyl-phenyl)pyrazole-3-carboxamide Openeye Name: N-(2-hydroxy-5-nitro-phenyl)-1,5-dimethyl-4-nitro-pyrazole-3-carboxamide CAS Name: N-(2-hydroxy-5-nitrophenyl)-1,5-dimethyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: N-(2-hydroxy-5-nitrophenyl)-1,5-dimethyl-4-nitropyrazole-3-carboxamide Traditional Name: N-(2-hydroxy-5-nitro-phenyl)-1,5-dimethyl-4-nitro-pyrazole-3-carboxamide Formula: C12H11N5O6 MolecularWeight: 321.24564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])O)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1C)C(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])O)[N+](=O)[O-]

InChI

InChI=1S/C12H11N5O6/c1-6-11(17(22)23)10(14-15(6)2)12(19)13-8-5-7(16(20)21)3-4-9(8)18/h3-5,18H,1-2H3,(H,13,19)