2,5-dimethyl-4-nitro-N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]pyrazole-3-carboxamide

Systemtic Name: 2,5-dimethyl-4-nitro-N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]pyrazole-3-carboxamide Openeye Name: 2,5-dimethyl-4-nitro-N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]pyrazole-3-carboxamide CAS Name: 2,5-dimethyl-4-nitro-N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]-3-pyrazolecarboxamide IUPAC Name: 2,5-dimethyl-4-nitro-N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]pyrazole-3-carboxamide Traditional Name: 2,5-dimethyl-4-nitro-N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]pyrazole-3-carboxamide 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)C3=C(C(=NN3C)C)[N+](=O)[O-])C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=C(C(=NN3C)C)[N+](=O)[O-])C)C

InChI

InChI=1S/C21H21N5O6/c1-11-6-12(2)13(3)18(7-11)32-17-9-15(8-16(10-17)25(28)29)22-21(27)20-19(26(30)31)14(4)23-24(20)5/h6-10H,1-5H3,(H,22,27)