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

Systemtic Name: 2-(4-bromanyl-3-methyl-pyrazol-1-yl)propanoic acid Openeye Name: 2-(4-bromo-3-methyl-pyrazol-1-yl)propanoic acid CAS Name: 2-(4-bromo-3-methyl-1-pyrazolyl)propanoic acid IUPAC Name: 2-(4-bromo-3-methylpyrazol-1-yl)propanoic acid Traditional Name: 2-(4-bromo-3-methyl-pyrazol-1-yl)propionic acid Formula: C7H9BrN2O2 MolecularWeight: 233.06256

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H9BrN2O2/c1-4-6(8)3-10(9-4)5(2)7(11)12/h3,5H,1-2H3,(H,11,12)