(2R)-2-(4-bromanylpyrazol-1-yl)-1-[(3S,5S)-3,5-dimethylpiperidin-1-yl]propan-1-one

Systemtic Name: (2R)-2-(4-bromanylpyrazol-1-yl)-1-[(3S,5S)-3,5-dimethylpiperidin-1-yl]propan-1-one Openeye Name: (2R)-2-(4-bromopyrazol-1-yl)-1-[(3S,5S)-3,5-dimethyl-1-piperidyl]propan-1-one CAS Name: (2R)-2-(4-bromo-1-pyrazolyl)-1-[(3S,5S)-3,5-dimethyl-1-piperidinyl]-1-propanone IUPAC Name: (2R)-2-(4-bromopyrazol-1-yl)-1-[(3S,5S)-3,5-dimethylpiperidin-1-yl]propan-1-one Traditional Name: (2R)-2-(4-bromopyrazol-1-yl)-1-[(3S,5S)-3,5-dimethylpiperidino]propan-1-one Formula: C13H20BrN3O MolecularWeight: 314.2214

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)C(C)N2C=C(C=N2)Br)C

Isomeric SMILES

C[C@H]1C[C@@H](CN(C1)C(=O)[C@@H](C)N2C=C(C=N2)Br)C

InChI

InChI=1S/C13H20BrN3O/c1-9-4-10(2)7-16(6-9)13(18)11(3)17-8-12(14)5-15-17/h5,8-11H,4,6-7H2,1-3H3/t9-,10-,11+/m0/s1