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

Systemtic Name: 1-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanone Openeye Name: 1-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanone CAS Name: 1-[(2S,6S)-2,6-dimethyl-4-morpholinyl]-2-(3,5-dimethyl-4-nitro-1-pyrazolyl)ethanone IUPAC Name: 1-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-2-(3,5-dimethyl-4-nitropyrazol-1-yl)ethanone Traditional Name: 1-[(2S,6S)-2,6-dimethylmorpholino]-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanone Formula: C13H20N4O4 MolecularWeight: 296.3223

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)C(=O)CN2C(=C(C(=N2)C)[N+](=O)[O-])C

Isomeric SMILES

C[C@H]1CN(C[C@@H](O1)C)C(=O)CN2C(=C(C(=N2)C)[N+](=O)[O-])C

InChI

InChI=1S/C13H20N4O4/c1-8-5-15(6-9(2)21-8)12(18)7-16-11(4)13(17(19)20)10(3)14-16/h8-9H,5-7H2,1-4H3/t8-,9-/m0/s1