2-[5-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-1,2,3,4-tetrazol-2-yl]ethanoic acid

Systemtic Name: 2-[5-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-1,2,3,4-tetrazol-2-yl]ethanoic acid Openeye Name: 2-[5-(4-bromo-3,5-dimethyl-pyrazol-1-yl)tetrazol-2-yl]acetic acid CAS Name: 2-[5-(4-bromo-3,5-dimethyl-1-pyrazolyl)-2-tetrazolyl]acetic acid IUPAC Name: 2-[5-(4-bromo-3,5-dimethylpyrazol-1-yl)tetrazol-2-yl]acetic acid Traditional Name: 2-[5-(4-bromo-3,5-dimethyl-pyrazol-1-yl)tetrazol-2-yl]acetic acid Formula: C8H9BrN6O2 MolecularWeight: 301.10006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=NN(N=N2)CC(=O)O)C)Br

Isomeric SMILES

CC1=C(C(=NN1C2=NN(N=N2)CC(=O)O)C)Br

InChI

InChI=1S/C8H9BrN6O2/c1-4-7(9)5(2)15(11-4)8-10-13-14(12-8)3-6(16)17/h3H2,1-2H3,(H,16,17)