1-[4-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)carbonylpiperidin-1-yl]ethanone

Systemtic Name: 1-[4-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)carbonylpiperidin-1-yl]ethanone Openeye Name: 1-[4-(4-bromo-3,5-dimethyl-pyrazole-1-carbonyl)-1-piperidyl]ethanone CAS Name: 1-[4-[(4-bromo-3,5-dimethyl-1-pyrazolyl)-oxomethyl]-1-piperidinyl]ethanone IUPAC Name: 1-[4-(4-bromo-3,5-dimethylpyrazole-1-carbonyl)piperidin-1-yl]ethanone Traditional Name: 1-[4-(4-bromo-3,5-dimethyl-pyrazole-1-carbonyl)piperidino]ethanone Formula: C13H18BrN3O2 MolecularWeight: 328.20492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(=O)C2CCN(CC2)C(=O)C)C)Br

Isomeric SMILES

CC1=C(C(=NN1C(=O)C2CCN(CC2)C(=O)C)C)Br

InChI

InChI=1S/C13H18BrN3O2/c1-8-12(14)9(2)17(15-8)13(19)11-4-6-16(7-5-11)10(3)18/h11H,4-7H2,1-3H3