3-(2-bromanyl-5-methyl-phenyl)-1H-pyrazole-5-carboxylic acid

Systemtic Name: 3-(2-bromanyl-5-methyl-phenyl)-1H-pyrazole-5-carboxylic acid Openeye Name: 3-(2-bromo-5-methyl-phenyl)-1H-pyrazole-5-carboxylic acid CAS Name: 3-(2-bromo-5-methylphenyl)-1H-pyrazole-5-carboxylic acid IUPAC Name: 3-(2-bromo-5-methylphenyl)-1H-pyrazole-5-carboxylic acid Traditional Name: 3-(2-bromo-5-methyl-phenyl)-1H-pyrazole-5-carboxylic acid Formula: C11H9BrN2O2 MolecularWeight: 281.10536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)Br)C2=NNC(=C2)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)Br)C2=NNC(=C2)C(=O)O

InChI

InChI=1S/C11H9BrN2O2/c1-6-2-3-8(12)7(4-6)9-5-10(11(15)16)14-13-9/h2-5H,1H3,(H,13,14)(H,15,16)