2-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-1-[(2S,6S)-2,6-dimethylmorpholin-4-yl]ethanone

Systemtic Name: 2-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-1-[(2S,6S)-2,6-dimethylmorpholin-4-yl]ethanone Openeye Name: 2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-1-[(2S,6S)-2,6-dimethylmorpholin-4-yl]ethanone CAS Name: 2-(4-bromo-3,5-dimethyl-1-pyrazolyl)-1-[(2S,6S)-2,6-dimethyl-4-morpholinyl]ethanone IUPAC Name: 2-(4-bromo-3,5-dimethylpyrazol-1-yl)-1-[(2S,6S)-2,6-dimethylmorpholin-4-yl]ethanone Traditional Name: 2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-1-[(2S,6S)-2,6-dimethylmorpholino]ethanone Formula: C13H20BrN3O2 MolecularWeight: 330.2208

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)C(=O)CN2C(=C(C(=N2)C)Br)C

Isomeric SMILES

C[C@H]1CN(C[C@@H](O1)C)C(=O)CN2C(=C(C(=N2)C)Br)C

InChI

InChI=1S/C13H20BrN3O2/c1-8-5-16(6-9(2)19-8)12(18)7-17-11(4)13(14)10(3)15-17/h8-9H,5-7H2,1-4H3/t8-,9-/m0/s1