1-methyl-N-(4-methyl-3,5-dinitro-phenyl)-5-(trifluoromethyl)pyrazole-3-carboxamide

Systemtic Name: 1-methyl-N-(4-methyl-3,5-dinitro-phenyl)-5-(trifluoromethyl)pyrazole-3-carboxamide Openeye Name: 1-methyl-N-(4-methyl-3,5-dinitro-phenyl)-5-(trifluoromethyl)pyrazole-3-carboxamide CAS Name: 1-methyl-N-(4-methyl-3,5-dinitrophenyl)-5-(trifluoromethyl)-3-pyrazolecarboxamide IUPAC Name: 1-methyl-N-(4-methyl-3,5-dinitrophenyl)-5-(trifluoromethyl)pyrazole-3-carboxamide Traditional Name: 1-methyl-N-(4-methyl-3,5-dinitro-phenyl)-5-(trifluoromethyl)pyrazole-3-carboxamide Formula: C13H10F3N5O5 MolecularWeight: 373.24421

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1[N+](=O)[O-])NC(=O)C2=NN(C(=C2)C(F)(F)F)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])NC(=O)C2=NN(C(=C2)C(F)(F)F)C)[N+](=O)[O-]

InChI

InChI=1S/C13H10F3N5O5/c1-6-9(20(23)24)3-7(4-10(6)21(25)26)17-12(22)8-5-11(13(14,15)16)19(2)18-8/h3-5H,1-2H3,(H,17,22)