4-bromanyl-5-ethyl-2-methyl-pyrazole-3-carboxylate

Systemtic Name: 4-bromanyl-5-ethyl-2-methyl-pyrazole-3-carboxylate Openeye Name: 4-bromo-5-ethyl-2-methyl-pyrazole-3-carboxylate CAS Name: 4-bromo-5-ethyl-2-methyl-3-pyrazolecarboxylate IUPAC Name: 4-bromo-5-ethyl-2-methylpyrazole-3-carboxylate Traditional Name: 4-bromo-5-ethyl-2-methyl-pyrazole-3-carboxylate Formula: C7H8BrN2O2- MolecularWeight: 232.05462

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=C1Br)C(=O)[O-])C

Isomeric SMILES

CCC1=NN(C(=C1Br)C(=O)[O-])C

InChI

InChI=1S/C7H9BrN2O2/c1-3-4-5(8)6(7(11)12)10(2)9-4/h3H2,1-2H3,(H,11,12)/p-1