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

Systemtic Name: N-[3-(3,5-dimethylphenoxy)-5-nitro-phenyl]-2-(5-methyl-3,4-dinitro-pyrazol-1-yl)ethanamide Openeye Name: N-[3-(3,5-dimethylphenoxy)-5-nitro-phenyl]-2-(5-methyl-3,4-dinitro-pyrazol-1-yl)acetamide CAS Name: N-[3-(3,5-dimethylphenoxy)-5-nitrophenyl]-2-(5-methyl-3,4-dinitro-1-pyrazolyl)acetamide IUPAC Name: N-[3-(3,5-dimethylphenoxy)-5-nitrophenyl]-2-(5-methyl-3,4-dinitropyrazol-1-yl)acetamide Traditional Name: N-[3-(3,5-dimethylphenoxy)-5-nitro-phenyl]-2-(5-methyl-3,4-dinitro-pyrazol-1-yl)acetamide Formula: C20H18N6O8 MolecularWeight: 470.39232

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18N6O8/c1-11-4-12(2)6-16(5-11)34-17-8-14(7-15(9-17)24(28)29)21-18(27)10-23-13(3)19(25(30)31)20(22-23)26(32)33/h4-9H,10H2,1-3H3,(H,21,27)