3-(4-bromophenyl)-1-methyl-pyrazole-4-carboxylate

Systemtic Name: 3-(4-bromophenyl)-1-methyl-pyrazole-4-carboxylate Openeye Name: 3-(4-bromophenyl)-1-methyl-pyrazole-4-carboxylate CAS Name: 3-(4-bromophenyl)-1-methyl-4-pyrazolecarboxylate IUPAC Name: 3-(4-bromophenyl)-1-methylpyrazole-4-carboxylate Traditional Name: 3-(4-bromophenyl)-1-methyl-pyrazole-4-carboxylate Formula: C11H8BrN2O2- MolecularWeight: 280.09742

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C2=CC=C(C=C2)Br)C(=O)[O-]

Isomeric SMILES

CN1C=C(C(=N1)C2=CC=C(C=C2)Br)C(=O)[O-]

InChI

InChI=1S/C11H9BrN2O2/c1-14-6-9(11(15)16)10(13-14)7-2-4-8(12)5-3-7/h2-6H,1H3,(H,15,16)/p-1