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

Systemtic Name: 2-(5-methyl-3-nitro-pyrazol-1-yl)-N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]ethanamide Openeye Name: 2-(5-methyl-3-nitro-pyrazol-1-yl)-N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]acetamide CAS Name: 2-(5-methyl-3-nitro-1-pyrazolyl)-N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]acetamide IUPAC Name: 2-(5-methyl-3-nitropyrazol-1-yl)-N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]acetamide Traditional Name: 2-(5-methyl-3-nitro-pyrazol-1-yl)-N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]acetamide Formula: C21H21N5O6 MolecularWeight: 439.42134

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21N5O6/c1-12-5-13(2)15(4)19(6-12)32-18-9-16(8-17(10-18)25(28)29)22-21(27)11-24-14(3)7-20(23-24)26(30)31/h5-10H,11H2,1-4H3,(H,22,27)