5-nitro-3-oxabicyclo[2.2.2]octa-1(6),4,7-trien-2-one

Systemtic Name: 5-nitro-3-oxabicyclo[2.2.2]octa-1(6),4,7-trien-2-one Openeye Name: 5-nitro-3-oxabicyclo[2.2.2]octa-1(6),4,7-trien-2-one CAS Name: 5-nitro-3-oxabicyclo[2.2.2]octa-1(6),4,7-trien-2-one IUPAC Name: 5-nitro-3-oxabicyclo[2.2.2]octa-1(6),4,7-trien-2-one Traditional Name: 5-nitro-3-oxabicyclo[2.2.2]octa-1(6),4,7-trien-2-one Formula: C7H3NO4 MolecularWeight: 165.10302

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(=O)O2)[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C(C=C1C(=O)O2)[N+](=O)[O-]

InChI

InChI=1S/C7H3NO4/c9-7-4-1-2-6(12-7)5(3-4)8(10)11/h1-3H