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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C=C1Br)C

Isomeric SMILES

CCOC(=O)C1=NN(C=C1Br)C

InChI

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