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

Systemtic Name: 4-bromanyl-5-(2-methylpropyl)-1H-pyrazole-3-carboxylic acid Openeye Name: 4-bromo-5-isobutyl-1H-pyrazole-3-carboxylic acid CAS Name: 4-bromo-5-(2-methylpropyl)-1H-pyrazole-3-carboxylic acid IUPAC Name: 4-bromo-5-(2-methylpropyl)-1H-pyrazole-3-carboxylic acid Traditional Name: 4-bromo-5-isobutyl-1H-pyrazole-3-carboxylic acid Formula: C8H11BrN2O2 MolecularWeight: 247.08914

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C(C(=NN1)C(=O)O)Br

Isomeric SMILES

CC(C)CC1=C(C(=NN1)C(=O)O)Br

InChI

InChI=1S/C8H11BrN2O2/c1-4(2)3-5-6(9)7(8(12)13)11-10-5/h4H,3H2,1-2H3,(H,10,11)(H,12,13)