(2R)-2-(4-bromanyl-3-methyl-pyrazol-1-yl)-1-[(2S)-2-methylpiperidin-1-yl]propan-1-one

Systemtic Name: (2R)-2-(4-bromanyl-3-methyl-pyrazol-1-yl)-1-[(2S)-2-methylpiperidin-1-yl]propan-1-one Openeye Name: (2R)-2-(4-bromo-3-methyl-pyrazol-1-yl)-1-[(2S)-2-methyl-1-piperidyl]propan-1-one CAS Name: (2R)-2-(4-bromo-3-methyl-1-pyrazolyl)-1-[(2S)-2-methyl-1-piperidinyl]-1-propanone IUPAC Name: (2R)-2-(4-bromo-3-methylpyrazol-1-yl)-1-[(2S)-2-methylpiperidin-1-yl]propan-1-one Traditional Name: (2R)-2-(4-bromo-3-methyl-pyrazol-1-yl)-1-[(2S)-2-methylpiperidino]propan-1-one Formula: C13H20BrN3O MolecularWeight: 314.2214

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=O)C(C)N2C=C(C(=N2)C)Br

Isomeric SMILES

C[C@H]1CCCCN1C(=O)[C@@H](C)N2C=C(C(=N2)C)Br

InChI

InChI=1S/C13H20BrN3O/c1-9-6-4-5-7-16(9)13(18)11(3)17-8-12(14)10(2)15-17/h8-9,11H,4-7H2,1-3H3/t9-,11+/m0/s1