3-(5-bromanyl-3-nitro-1,2,4-triazol-1-yl)-6,8-dioxabicyclo[3.2.1]octan-4-one

Systemtic Name: 3-(5-bromanyl-3-nitro-1,2,4-triazol-1-yl)-6,8-dioxabicyclo[3.2.1]octan-4-one Openeye Name: 3-(5-bromo-3-nitro-1,2,4-triazol-1-yl)-6,8-dioxabicyclo[3.2.1]octan-4-one CAS Name: 3-(5-bromo-3-nitro-1,2,4-triazol-1-yl)-6,8-dioxabicyclo[3.2.1]octan-4-one IUPAC Name: 3-(5-bromo-3-nitro-1,2,4-triazol-1-yl)-6,8-dioxabicyclo[3.2.1]octan-4-one Traditional Name: 3-(5-bromo-3-nitro-1,2,4-triazol-1-yl)-6,8-dioxabicyclo[3.2.1]octan-4-one Formula: C8H7BrN4O5 MolecularWeight: 319.06898

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Descriptors Computed from Structure

Canonical SMILES:

C1C2COC(O2)C(=O)C1N3C(=NC(=N3)[N+](=O)[O-])Br

Isomeric SMILES

C1C2COC(O2)C(=O)C1N3C(=NC(=N3)[N+](=O)[O-])Br

InChI

InChI=1S/C8H7BrN4O5/c9-7-10-8(13(15)16)11-12(7)4-1-3-2-17-6(18-3)5(4)14/h3-4,6H,1-2H2