2-(4-bromanyl-3-methyl-pyrazol-1-yl)ethanoate

Systemtic Name: 2-(4-bromanyl-3-methyl-pyrazol-1-yl)ethanoate Openeye Name: 2-(4-bromo-3-methyl-pyrazol-1-yl)acetate CAS Name: 2-(4-bromo-3-methyl-1-pyrazolyl)acetate IUPAC Name: 2-(4-bromo-3-methylpyrazol-1-yl)acetate Traditional Name: 2-(4-bromo-3-methyl-pyrazol-1-yl)acetate Formula: C6H6BrN2O2- MolecularWeight: 218.02804

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H7BrN2O2/c1-4-5(7)2-9(8-4)3-6(10)11/h2H,3H2,1H3,(H,10,11)/p-1