4-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-1-morpholin-4-yl-butan-1-one

Systemtic Name: 4-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-1-morpholin-4-yl-butan-1-one Openeye Name: 4-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-1-morpholino-butan-1-one CAS Name: 4-(3,5-dimethyl-4-nitro-1-pyrazolyl)-1-(4-morpholinyl)-1-butanone IUPAC Name: 4-(3,5-dimethyl-4-nitropyrazol-1-yl)-1-morpholin-4-ylbutan-1-one Traditional Name: 4-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-1-morpholino-butan-1-one Formula: C13H20N4O4 MolecularWeight: 296.3223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCCC(=O)N2CCOCC2)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CCCC(=O)N2CCOCC2)C)[N+](=O)[O-]

InChI

InChI=1S/C13H20N4O4/c1-10-13(17(19)20)11(2)16(14-10)5-3-4-12(18)15-6-8-21-9-7-15/h3-9H2,1-2H3