2-bromanyl-4,4,5-trimethyl-pyrazol-3-one

Systemtic Name: 2-bromanyl-4,4,5-trimethyl-pyrazol-3-one Openeye Name: 2-bromo-4,4,5-trimethyl-pyrazol-3-one CAS Name: 2-bromo-4,4,5-trimethyl-3-pyrazolone IUPAC Name: 2-bromo-4,4,5-trimethylpyrazol-3-one Traditional Name: 2-bromo-4,4,5-trimethyl-2-pyrazolin-3-one Formula: C6H9BrN2O MolecularWeight: 205.05246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1(C)C)Br

Isomeric SMILES

CC1=NN(C(=O)C1(C)C)Br

InChI

InChI=1S/C6H9BrN2O/c1-4-6(2,3)5(10)9(7)8-4/h1-3H3