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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1[N+](=O)[O-])C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])O)C

Isomeric SMILES

CC1=NN(C(=C1[N+](=O)[O-])C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])O)C

InChI

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