4-bromanyl-3-(4-methoxyphenyl)-1H-pyrazole-5-carboxylic acid

Systemtic Name: 4-bromanyl-3-(4-methoxyphenyl)-1H-pyrazole-5-carboxylic acid Openeye Name: 4-bromo-3-(4-methoxyphenyl)-1H-pyrazole-5-carboxylic acid CAS Name: 4-bromo-3-(4-methoxyphenyl)-1H-pyrazole-5-carboxylic acid IUPAC Name: 4-bromo-3-(4-methoxyphenyl)-1H-pyrazole-5-carboxylic acid Traditional Name: 4-bromo-3-(4-methoxyphenyl)-1H-pyrazole-5-carboxylic acid Formula: C11H9BrN2O3 MolecularWeight: 297.10476

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NNC(=C2Br)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)C2=NNC(=C2Br)C(=O)O

InChI

InChI=1S/C11H9BrN2O3/c1-17-7-4-2-6(3-5-7)9-8(12)10(11(15)16)14-13-9/h2-5H,1H3,(H,13,14)(H,15,16)