4-bromanyl-2,5-dimethyl-pyrazole-3-carboxylate

Systemtic Name: 4-bromanyl-2,5-dimethyl-pyrazole-3-carboxylate Openeye Name: 4-bromo-2,5-dimethyl-pyrazole-3-carboxylate CAS Name: 4-bromo-2,5-dimethyl-3-pyrazolecarboxylate IUPAC Name: 4-bromo-2,5-dimethylpyrazole-3-carboxylate Traditional Name: 4-bromo-2,5-dimethyl-pyrazole-3-carboxylate Formula: C6H6BrN2O2- MolecularWeight: 218.02804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1Br)C(=O)[O-])C

Isomeric SMILES

CC1=NN(C(=C1Br)C(=O)[O-])C

InChI

InChI=1S/C6H7BrN2O2/c1-3-4(7)5(6(10)11)9(2)8-3/h1-2H3,(H,10,11)/p-1