tert-butyl 1-(2,4-dinitrophenyl)-3-methyl-pyrazole-4-carboxylate

Systemtic Name: tert-butyl 1-(2,4-dinitrophenyl)-3-methyl-pyrazole-4-carboxylate Openeye Name: tert-butyl 1-(2,4-dinitrophenyl)-3-methyl-pyrazole-4-carboxylate CAS Name: 1-(2,4-dinitrophenyl)-3-methyl-4-pyrazolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-(2,4-dinitrophenyl)-3-methylpyrazole-4-carboxylate Traditional Name: 1-(2,4-dinitrophenyl)-3-methyl-pyrazole-4-carboxylic acid tert-butyl ester Formula: C15H16N4O6 MolecularWeight: 348.31074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1C(=O)OC(C)(C)C)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=NN(C=C1C(=O)OC(C)(C)C)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H16N4O6/c1-9-11(14(20)25-15(2,3)4)8-17(16-9)12-6-5-10(18(21)22)7-13(12)19(23)24/h5-8H,1-4H3