1-(3-bromophenyl)-3,5-dimethyl-pyrazole-4-carboxylic acid

Systemtic Name: 1-(3-bromophenyl)-3,5-dimethyl-pyrazole-4-carboxylic acid Openeye Name: 1-(3-bromophenyl)-3,5-dimethyl-pyrazole-4-carboxylic acid CAS Name: 1-(3-bromophenyl)-3,5-dimethyl-4-pyrazolecarboxylic acid IUPAC Name: 1-(3-bromophenyl)-3,5-dimethylpyrazole-4-carboxylic acid Traditional Name: 1-(3-bromophenyl)-3,5-dimethyl-pyrazole-4-carboxylic acid Formula: C12H11BrN2O2 MolecularWeight: 295.13194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC(=CC=C2)Br)C)C(=O)O

Isomeric SMILES

CC1=C(C(=NN1C2=CC(=CC=C2)Br)C)C(=O)O

InChI

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