2-(4-bromanyl-3-methyl-pyrazol-1-yl)-2-methyl-propanoic acid

Systemtic Name: 2-(4-bromanyl-3-methyl-pyrazol-1-yl)-2-methyl-propanoic acid Openeye Name: 2-(4-bromo-3-methyl-pyrazol-1-yl)-2-methyl-propanoic acid CAS Name: 2-(4-bromo-3-methyl-1-pyrazolyl)-2-methylpropanoic acid IUPAC Name: 2-(4-bromo-3-methylpyrazol-1-yl)-2-methylpropanoic acid Traditional Name: 2-(4-bromo-3-methyl-pyrazol-1-yl)-2-methyl-propionic acid Formula: C8H11BrN2O2 MolecularWeight: 247.08914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1Br)C(C)(C)C(=O)O

Isomeric SMILES

CC1=NN(C=C1Br)C(C)(C)C(=O)O

InChI

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