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

Systemtic Name: N-(4-ethoxy-2-nitro-phenyl)-1-[(3-nitro-1,2,4-triazol-1-yl)methyl]pyrazole-3-carboxamide Openeye Name: N-(4-ethoxy-2-nitro-phenyl)-1-[(3-nitro-1,2,4-triazol-1-yl)methyl]pyrazole-3-carboxamide CAS Name: N-(4-ethoxy-2-nitrophenyl)-1-[(3-nitro-1,2,4-triazol-1-yl)methyl]-3-pyrazolecarboxamide IUPAC Name: N-(4-ethoxy-2-nitrophenyl)-1-[(3-nitro-1,2,4-triazol-1-yl)methyl]pyrazole-3-carboxamide Traditional Name: N-(4-ethoxy-2-nitro-phenyl)-1-[(3-nitro-1,2,4-triazol-1-yl)methyl]pyrazole-3-carboxamide Formula: C15H14N8O6 MolecularWeight: 402.32166

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)NC(=O)C2=NN(C=C2)CN3C=NC(=N3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC(=C(C=C1)NC(=O)C2=NN(C=C2)CN3C=NC(=N3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H14N8O6/c1-2-29-10-3-4-11(13(7-10)22(25)26)17-14(24)12-5-6-20(18-12)9-21-8-16-15(19-21)23(27)28/h3-8H,2,9H2,1H3,(H,17,24)