2-[4-bromanyl-3-(1-ethyl-5-methyl-pyrazol-4-yl)pyrazol-1-yl]ethanoic acid

Systemtic Name: 2-[4-bromanyl-3-(1-ethyl-5-methyl-pyrazol-4-yl)pyrazol-1-yl]ethanoic acid Openeye Name: 2-[4-bromo-3-(1-ethyl-5-methyl-pyrazol-4-yl)pyrazol-1-yl]acetic acid CAS Name: 2-[4-bromo-3-(1-ethyl-5-methyl-4-pyrazolyl)-1-pyrazolyl]acetic acid IUPAC Name: 2-[4-bromo-3-(1-ethyl-5-methylpyrazol-4-yl)pyrazol-1-yl]acetic acid Traditional Name: 2-[4-bromo-3-(1-ethyl-5-methyl-pyrazol-4-yl)pyrazol-1-yl]acetic acid Formula: C11H13BrN4O2 MolecularWeight: 313.15052

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)C2=NN(C=C2Br)CC(=O)O)C

Isomeric SMILES

CCN1C(=C(C=N1)C2=NN(C=C2Br)CC(=O)O)C

InChI

InChI=1S/C11H13BrN4O2/c1-3-16-7(2)8(4-13-16)11-9(12)5-15(14-11)6-10(17)18/h4-5H,3,6H2,1-2H3,(H,17,18)