4-bromanyl-3-(2-methylphenyl)-1H-pyrazole-5-carboxylic acid

Systemtic Name: 4-bromanyl-3-(2-methylphenyl)-1H-pyrazole-5-carboxylic acid Openeye Name: 4-bromo-3-(o-tolyl)-1H-pyrazole-5-carboxylic acid CAS Name: 4-bromo-3-(2-methylphenyl)-1H-pyrazole-5-carboxylic acid IUPAC Name: 4-bromo-3-(2-methylphenyl)-1H-pyrazole-5-carboxylic acid Traditional Name: 4-bromo-3-(o-tolyl)-1H-pyrazole-5-carboxylic acid Formula: C11H9BrN2O2 MolecularWeight: 281.10536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NNC(=C2Br)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1C2=NNC(=C2Br)C(=O)O

InChI

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