(1S,2S,5R)-2-(3-nitropyrazol-1-yl)-6,8-dioxabicyclo[3.2.1]octan-4-one

Systemtic Name: (1S,2S,5R)-2-(3-nitropyrazol-1-yl)-6,8-dioxabicyclo[3.2.1]octan-4-one Openeye Name: (1S,2S,5R)-2-(3-nitropyrazol-1-yl)-6,8-dioxabicyclo[3.2.1]octan-4-one CAS Name: (1S,2S,5R)-2-(3-nitro-1-pyrazolyl)-6,8-dioxabicyclo[3.2.1]octan-4-one IUPAC Name: (1S,2S,5R)-2-(3-nitropyrazol-1-yl)-6,8-dioxabicyclo[3.2.1]octan-4-one Traditional Name: (1S,2S,5R)-2-(3-nitropyrazol-1-yl)-6,8-dioxabicyclo[3.2.1]octan-4-one Formula: C9H9N3O5 MolecularWeight: 239.18486

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C2COC(C1=O)O2)N3C=CC(=N3)[N+](=O)[O-]

Isomeric SMILES

C1[C@@H]([C@H]2CO[C@@H](C1=O)O2)N3C=CC(=N3)[N+](=O)[O-]

InChI

InChI=1S/C9H9N3O5/c13-6-3-5(7-4-16-9(6)17-7)11-2-1-8(10-11)12(14)15/h1-2,5,7,9H,3-4H2/t5-,7+,9+/m0/s1