dimethyl 3-(2-bromanylethanoyl)-1H-pyrazole-4,5-dicarboxylate

Systemtic Name: dimethyl 3-(2-bromanylethanoyl)-1H-pyrazole-4,5-dicarboxylate Openeye Name: dimethyl 3-(2-bromoacetyl)-1H-pyrazole-4,5-dicarboxylate CAS Name: 3-(2-bromo-1-oxoethyl)-1H-pyrazole-4,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-(2-bromoacetyl)-1H-pyrazole-4,5-dicarboxylate Traditional Name: 3-(2-bromoacetyl)-1H-pyrazole-4,5-dicarboxylic acid dimethyl ester Formula: C9H9BrN2O5 MolecularWeight: 305.08216

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(NN=C1C(=O)CBr)C(=O)OC

Isomeric SMILES

COC(=O)C1=C(NN=C1C(=O)CBr)C(=O)OC

InChI

InChI=1S/C9H9BrN2O5/c1-16-8(14)5-6(4(13)3-10)11-12-7(5)9(15)17-2/h3H2,1-2H3,(H,11,12)