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

Systemtic Name: methyl 1-(2,4-dinitrophenyl)-3-methyl-pyrazole-4-carboxylate Openeye Name: methyl 1-(2,4-dinitrophenyl)-3-methyl-pyrazole-4-carboxylate CAS Name: 1-(2,4-dinitrophenyl)-3-methyl-4-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 1-(2,4-dinitrophenyl)-3-methylpyrazole-4-carboxylate Traditional Name: 1-(2,4-dinitrophenyl)-3-methyl-pyrazole-4-carboxylic acid methyl ester Formula: C12H10N4O6 MolecularWeight: 306.231

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H10N4O6/c1-7-9(12(17)22-2)6-14(13-7)10-4-3-8(15(18)19)5-11(10)16(20)21/h3-6H,1-2H3