1-(2-bromophenyl)-3,5-dimethyl-pyrazole-4-carboxylate

Systemtic Name: 1-(2-bromophenyl)-3,5-dimethyl-pyrazole-4-carboxylate Openeye Name: 1-(2-bromophenyl)-3,5-dimethyl-pyrazole-4-carboxylate CAS Name: 1-(2-bromophenyl)-3,5-dimethyl-4-pyrazolecarboxylate IUPAC Name: 1-(2-bromophenyl)-3,5-dimethylpyrazole-4-carboxylate Traditional Name: 1-(2-bromophenyl)-3,5-dimethyl-pyrazole-4-carboxylate Formula: C12H10BrN2O2- MolecularWeight: 294.124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2Br)C)C(=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2Br)C)C(=O)[O-]

InChI

InChI=1S/C12H11BrN2O2/c1-7-11(12(16)17)8(2)15(14-7)10-6-4-3-5-9(10)13/h3-6H,1-2H3,(H,16,17)/p-1