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

Systemtic Name: 1-iodanylprop-1-yne; 5-methoxy-3-oxabicyclo[2.2.2]octa-1(6),4,7-trien-2-one Openeye Name: 1-iodoprop-1-yne; 5-methoxy-3-oxabicyclo[2.2.2]octa-1(6),4,7-trien-2-one CAS Name: 1-iodo-1-propyne; 5-methoxy-3-oxabicyclo[2.2.2]octa-1(6),4,7-trien-2-one IUPAC Name: 1-iodoprop-1-yne; 5-methoxy-3-oxabicyclo[2.2.2]octa-1(6),4,7-trien-2-one Traditional Name: 1-iodoprop-1-yne; 5-methoxy-3-oxabicyclo[2.2.2]octa-1(6),4,7-trien-2-one Formula: C11H9IO3 MolecularWeight: 316.09183

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Descriptors Computed from Structure

Canonical SMILES:

CC#CI.COC1=C2C=CC(=C1)C(=O)O2

Isomeric SMILES

CC#CI.COC1=C2C=CC(=C1)C(=O)O2

InChI

InChI=1S/C8H6O3.C3H3I/c1-10-7-4-5-2-3-6(7)11-8(5)9;1-2-3-4/h2-4H,1H3;1H3