methyl 1-[(4-bromanylpyrazol-1-yl)methyl]pyrazole-3-carboxylate

Systemtic Name: methyl 1-[(4-bromanylpyrazol-1-yl)methyl]pyrazole-3-carboxylate Openeye Name: methyl 1-[(4-bromopyrazol-1-yl)methyl]pyrazole-3-carboxylate CAS Name: 1-[(4-bromo-1-pyrazolyl)methyl]-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 1-[(4-bromopyrazol-1-yl)methyl]pyrazole-3-carboxylate Traditional Name: 1-[(4-bromopyrazol-1-yl)methyl]pyrazole-3-carboxylic acid methyl ester Formula: C9H9BrN4O2 MolecularWeight: 285.09736

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NN(C=C1)CN2C=C(C=N2)Br

Isomeric SMILES

COC(=O)C1=NN(C=C1)CN2C=C(C=N2)Br

InChI

InChI=1S/C9H9BrN4O2/c1-16-9(15)8-2-3-13(12-8)6-14-5-7(10)4-11-14/h2-5H,6H2,1H3