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

Systemtic Name: 1-iodanylprop-1-yne; 5-nitro-3-oxabicyclo[2.2.2]octa-1(6),4,7-trien-2-one Openeye Name: 1-iodoprop-1-yne; 5-nitro-3-oxabicyclo[2.2.2]octa-1(6),4,7-trien-2-one CAS Name: 1-iodo-1-propyne; 5-nitro-3-oxabicyclo[2.2.2]octa-1(6),4,7-trien-2-one IUPAC Name: 1-iodoprop-1-yne; 5-nitro-3-oxabicyclo[2.2.2]octa-1(6),4,7-trien-2-one Traditional Name: 1-iodoprop-1-yne; 5-nitro-3-oxabicyclo[2.2.2]octa-1(6),4,7-trien-2-one Formula: C10H6INO4 MolecularWeight: 331.06341

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Descriptors Computed from Structure

Canonical SMILES:

CC#CI.C1=CC2=C(C=C1C(=O)O2)[N+](=O)[O-]

Isomeric SMILES

CC#CI.C1=CC2=C(C=C1C(=O)O2)[N+](=O)[O-]

InChI

InChI=1S/C7H3NO4.C3H3I/c9-7-4-1-2-6(12-7)5(3-4)8(10)11;1-2-3-4/h1-3H;1H3