1-[3,3-dinitro-2-(2-nitro-1-phenyl-cyclohexyl)oxy-1,2-oxazolidin-5-yl]ethanone

Systemtic Name: 1-[3,3-dinitro-2-(2-nitro-1-phenyl-cyclohexyl)oxy-1,2-oxazolidin-5-yl]ethanone Openeye Name: 1-[3,3-dinitro-2-(2-nitro-1-phenyl-cyclohexoxy)isoxazolidin-5-yl]ethanone CAS Name: 1-[3,3-dinitro-2-(2-nitro-1-phenylcyclohexyl)oxy-5-isoxazolidinyl]ethanone IUPAC Name: 1-[3,3-dinitro-2-(2-nitro-1-phenylcyclohexyl)oxy-1,2-oxazolidin-5-yl]ethanone Traditional Name: 1-[3,3-dinitro-2-(2-nitro-1-phenyl-cyclohexoxy)isoxazolidin-5-yl]ethanone Formula: C17H20N4O9 MolecularWeight: 424.3621

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1CC(N(O1)OC2(CCCCC2[N+](=O)[O-])C3=CC=CC=C3)([N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1CC(N(O1)OC2(CCCCC2[N+](=O)[O-])C3=CC=CC=C3)([N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H20N4O9/c1-12(22)14-11-17(19(25)26,20(27)28)21(29-14)30-16(13-7-3-2-4-8-13)10-6-5-9-15(16)18(23)24/h2-4,7-8,14-15H,5-6,9-11H2,1H3