4-bromanyl-5-methyl-1-phenyl-pyrazole-3-carboxylic acid

Systemtic Name: 4-bromanyl-5-methyl-1-phenyl-pyrazole-3-carboxylic acid Openeye Name: 4-bromo-5-methyl-1-phenyl-pyrazole-3-carboxylic acid CAS Name: 4-bromo-5-methyl-1-phenyl-3-pyrazolecarboxylic acid IUPAC Name: 4-bromo-5-methyl-1-phenylpyrazole-3-carboxylic acid Traditional Name: 4-bromo-5-methyl-1-phenyl-pyrazole-3-carboxylic acid Formula: C11H9BrN2O2 MolecularWeight: 281.10536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C(=O)O)Br

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C(=O)O)Br

InChI

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