3-(2,6-dimethylmorpholin-4-yl)-1-[3-nitro-4,5-bis(oxidanyl)phenyl]propan-1-one

Systemtic Name: 3-(2,6-dimethylmorpholin-4-yl)-1-[3-nitro-4,5-bis(oxidanyl)phenyl]propan-1-one Openeye Name: 1-(3,4-dihydroxy-5-nitro-phenyl)-3-(2,6-dimethylmorpholin-4-yl)propan-1-one CAS Name: 1-(3,4-dihydroxy-5-nitrophenyl)-3-(2,6-dimethyl-4-morpholinyl)-1-propanone IUPAC Name: 1-(3,4-dihydroxy-5-nitrophenyl)-3-(2,6-dimethylmorpholin-4-yl)propan-1-one Traditional Name: 1-(3,4-dihydroxy-5-nitro-phenyl)-3-(2,6-dimethylmorpholino)propan-1-one Formula: C15H20N2O6 MolecularWeight: 324.3291

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)CCC(=O)C2=CC(=C(C(=C2)O)O)[N+](=O)[O-]

Isomeric SMILES

CC1CN(CC(O1)C)CCC(=O)C2=CC(=C(C(=C2)O)O)[N+](=O)[O-]

InChI

InChI=1S/C15H20N2O6/c1-9-7-16(8-10(2)23-9)4-3-13(18)11-5-12(17(21)22)15(20)14(19)6-11/h5-6,9-10,19-20H,3-4,7-8H2,1-2H3