N-[3-(3,5-dimethylphenoxy)-5-nitro-phenyl]-1-ethyl-4-nitro-pyrazole-3-carboxamide

Systemtic Name: N-[3-(3,5-dimethylphenoxy)-5-nitro-phenyl]-1-ethyl-4-nitro-pyrazole-3-carboxamide Openeye Name: N-[3-(3,5-dimethylphenoxy)-5-nitro-phenyl]-1-ethyl-4-nitro-pyrazole-3-carboxamide CAS Name: N-[3-(3,5-dimethylphenoxy)-5-nitrophenyl]-1-ethyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: N-[3-(3,5-dimethylphenoxy)-5-nitrophenyl]-1-ethyl-4-nitropyrazole-3-carboxamide Traditional Name: N-[3-(3,5-dimethylphenoxy)-5-nitro-phenyl]-1-ethyl-4-nitro-pyrazole-3-carboxamide Formula: C20H19N5O6 MolecularWeight: 425.39476

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)NC2=CC(=CC(=C2)OC3=CC(=CC(=C3)C)C)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)NC2=CC(=CC(=C2)OC3=CC(=CC(=C3)C)C)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C20H19N5O6/c1-4-23-11-18(25(29)30)19(22-23)20(26)21-14-8-15(24(27)28)10-17(9-14)31-16-6-12(2)5-13(3)7-16/h5-11H,4H2,1-3H3,(H,21,26)