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

Systemtic Name: 4-bromanyl-2-ethyl-5-propyl-pyrazole-3-carboxylate Openeye Name: 4-bromo-2-ethyl-5-propyl-pyrazole-3-carboxylate CAS Name: 4-bromo-2-ethyl-5-propyl-3-pyrazolecarboxylate IUPAC Name: 4-bromo-2-ethyl-5-propylpyrazole-3-carboxylate Traditional Name: 4-bromo-2-ethyl-5-propyl-pyrazole-3-carboxylate Formula: C9H12BrN2O2- MolecularWeight: 260.10778

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=C1Br)C(=O)[O-])CC

Isomeric SMILES

CCCC1=NN(C(=C1Br)C(=O)[O-])CC

InChI

InChI=1S/C9H13BrN2O2/c1-3-5-6-7(10)8(9(13)14)12(4-2)11-6/h3-5H2,1-2H3,(H,13,14)/p-1