(2S)-2-(4-bromanyl-5-methyl-3-nitro-pyrazol-1-yl)-1-morpholin-4-yl-propan-1-one

Systemtic Name: (2S)-2-(4-bromanyl-5-methyl-3-nitro-pyrazol-1-yl)-1-morpholin-4-yl-propan-1-one Openeye Name: (2S)-2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)-1-morpholino-propan-1-one CAS Name: (2S)-2-(4-bromo-5-methyl-3-nitro-1-pyrazolyl)-1-(4-morpholinyl)-1-propanone IUPAC Name: (2S)-2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-1-morpholin-4-ylpropan-1-one Traditional Name: (2S)-2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)-1-morpholino-propan-1-one Formula: C11H15BrN4O4 MolecularWeight: 347.1652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(C)C(=O)N2CCOCC2)[N+](=O)[O-])Br

Isomeric SMILES

CC1=C(C(=NN1[C@@H](C)C(=O)N2CCOCC2)[N+](=O)[O-])Br

InChI

InChI=1S/C11H15BrN4O4/c1-7-9(12)10(16(18)19)13-15(7)8(2)11(17)14-3-5-20-6-4-14/h8H,3-6H2,1-2H3/t8-/m0/s1