N-(4-methyl-3,5-dinitro-phenyl)-1-[(3-nitro-1,2,4-triazol-1-yl)methyl]pyrazole-3-carboxamide

Systemtic Name: N-(4-methyl-3,5-dinitro-phenyl)-1-[(3-nitro-1,2,4-triazol-1-yl)methyl]pyrazole-3-carboxamide Openeye Name: N-(4-methyl-3,5-dinitro-phenyl)-1-[(3-nitro-1,2,4-triazol-1-yl)methyl]pyrazole-3-carboxamide CAS Name: N-(4-methyl-3,5-dinitrophenyl)-1-[(3-nitro-1,2,4-triazol-1-yl)methyl]-3-pyrazolecarboxamide IUPAC Name: N-(4-methyl-3,5-dinitrophenyl)-1-[(3-nitro-1,2,4-triazol-1-yl)methyl]pyrazole-3-carboxamide Traditional Name: N-(4-methyl-3,5-dinitro-phenyl)-1-[(3-nitro-1,2,4-triazol-1-yl)methyl]pyrazole-3-carboxamide Formula: C14H11N9O7 MolecularWeight: 417.29324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1[N+](=O)[O-])NC(=O)C2=NN(C=C2)CN3C=NC(=N3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])NC(=O)C2=NN(C=C2)CN3C=NC(=N3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H11N9O7/c1-8-11(21(25)26)4-9(5-12(8)22(27)28)16-13(24)10-2-3-19(17-10)7-20-6-15-14(18-20)23(29)30/h2-6H,7H2,1H3,(H,16,24)