5-(4-bromanyl-2-chloranyl-phenoxy)-1,3-dimethyl-pyrazole-4-carboxylic acid

Systemtic Name: 5-(4-bromanyl-2-chloranyl-phenoxy)-1,3-dimethyl-pyrazole-4-carboxylic acid Openeye Name: 5-(4-bromo-2-chloro-phenoxy)-1,3-dimethyl-pyrazole-4-carboxylic acid CAS Name: 5-(4-bromo-2-chlorophenoxy)-1,3-dimethyl-4-pyrazolecarboxylic acid IUPAC Name: 5-(4-bromo-2-chlorophenoxy)-1,3-dimethylpyrazole-4-carboxylic acid Traditional Name: 5-(4-bromo-2-chloro-phenoxy)-1,3-dimethyl-pyrazole-4-carboxylic acid Formula: C12H10BrClN2O3 MolecularWeight: 345.5764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)O)OC2=C(C=C(C=C2)Br)Cl)C

Isomeric SMILES

CC1=NN(C(=C1C(=O)O)OC2=C(C=C(C=C2)Br)Cl)C

InChI

InChI=1S/C12H10BrClN2O3/c1-6-10(12(17)18)11(16(2)15-6)19-9-4-3-7(13)5-8(9)14/h3-5H,1-2H3,(H,17,18)