methyl 4-bromanyl-1-ethyl-pyrazole-3-carboxylate

Systemtic Name: methyl 4-bromanyl-1-ethyl-pyrazole-3-carboxylate Openeye Name: methyl 4-bromo-1-ethyl-pyrazole-3-carboxylate CAS Name: 4-bromo-1-ethyl-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 4-bromo-1-ethylpyrazole-3-carboxylate Traditional Name: 4-bromo-1-ethyl-pyrazole-3-carboxylic acid methyl ester Formula: C7H9BrN2O2 MolecularWeight: 233.06256

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)OC)Br

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)OC)Br

InChI

InChI=1S/C7H9BrN2O2/c1-3-10-4-5(8)6(9-10)7(11)12-2/h4H,3H2,1-2H3