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

Systemtic Name: methyl 4-bromanyl-1-methyl-pyrazole-3-carboxylate Openeye Name: methyl 4-bromo-1-methyl-pyrazole-3-carboxylate CAS Name: 4-bromo-1-methyl-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 4-bromo-1-methylpyrazole-3-carboxylate Traditional Name: 4-bromo-1-methyl-pyrazole-3-carboxylic acid methyl ester Formula: C6H7BrN2O2 MolecularWeight: 219.03598

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C(=O)OC)Br

Isomeric SMILES

CN1C=C(C(=N1)C(=O)OC)Br

InChI

InChI=1S/C6H7BrN2O2/c1-9-3-4(7)5(8-9)6(10)11-2/h3H,1-2H3