3-(5-bromanyl-2,4-dimethoxy-phenyl)-1H-pyrazole-5-carboxylic acid

Systemtic Name: 3-(5-bromanyl-2,4-dimethoxy-phenyl)-1H-pyrazole-5-carboxylic acid Openeye Name: 3-(5-bromo-2,4-dimethoxy-phenyl)-1H-pyrazole-5-carboxylic acid CAS Name: 3-(5-bromo-2,4-dimethoxyphenyl)-1H-pyrazole-5-carboxylic acid IUPAC Name: 3-(5-bromo-2,4-dimethoxyphenyl)-1H-pyrazole-5-carboxylic acid Traditional Name: 3-(5-bromo-2,4-dimethoxy-phenyl)-1H-pyrazole-5-carboxylic acid Formula: C12H11BrN2O4 MolecularWeight: 327.13074

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C2=NNC(=C2)C(=O)O)Br)OC

Isomeric SMILES

COC1=CC(=C(C=C1C2=NNC(=C2)C(=O)O)Br)OC

InChI

InChI=1S/C12H11BrN2O4/c1-18-10-5-11(19-2)7(13)3-6(10)8-4-9(12(16)17)15-14-8/h3-5H,1-2H3,(H,14,15)(H,16,17)