(4-methanoylphenyl) 4-bromanyl-1-methyl-pyrazole-3-carboxylate

Systemtic Name: (4-methanoylphenyl) 4-bromanyl-1-methyl-pyrazole-3-carboxylate Openeye Name: (4-formylphenyl) 4-bromo-1-methyl-pyrazole-3-carboxylate CAS Name: 4-bromo-1-methyl-3-pyrazolecarboxylic acid (4-formylphenyl) ester IUPAC Name: (4-formylphenyl) 4-bromo-1-methylpyrazole-3-carboxylate Traditional Name: 4-bromo-1-methyl-pyrazole-3-carboxylic acid (4-formylphenyl) ester Formula: C12H9BrN2O3 MolecularWeight: 309.11546

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C(=O)OC2=CC=C(C=C2)C=O)Br

Isomeric SMILES

CN1C=C(C(=N1)C(=O)OC2=CC=C(C=C2)C=O)Br

InChI

InChI=1S/C12H9BrN2O3/c1-15-6-10(13)11(14-15)12(17)18-9-4-2-8(7-16)3-5-9/h2-7H,1H3