N-[3-(2,5-dimethylphenoxy)-5-nitro-phenyl]-2-(4-nitropyrazol-1-yl)ethanamide

Systemtic Name: N-[3-(2,5-dimethylphenoxy)-5-nitro-phenyl]-2-(4-nitropyrazol-1-yl)ethanamide Openeye Name: N-[3-(2,5-dimethylphenoxy)-5-nitro-phenyl]-2-(4-nitropyrazol-1-yl)acetamide CAS Name: N-[3-(2,5-dimethylphenoxy)-5-nitrophenyl]-2-(4-nitro-1-pyrazolyl)acetamide IUPAC Name: N-[3-(2,5-dimethylphenoxy)-5-nitrophenyl]-2-(4-nitropyrazol-1-yl)acetamide Traditional Name: N-[3-(2,5-dimethylphenoxy)-5-nitro-phenyl]-2-(4-nitropyrazol-1-yl)acetamide Formula: C19H17N5O6 MolecularWeight: 411.36818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)CN3C=C(C=N3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)CN3C=C(C=N3)[N+](=O)[O-]

InChI

InChI=1S/C19H17N5O6/c1-12-3-4-13(2)18(5-12)30-17-7-14(6-15(8-17)23(26)27)21-19(25)11-22-10-16(9-20-22)24(28)29/h3-10H,11H2,1-2H3,(H,21,25)