6-ethyl-2,4-dioxabicyclo[3.2.2]nona-1(7),5,8-trien-3-one; 1-iodanylprop-1-yne

Systemtic Name: 6-ethyl-2,4-dioxabicyclo[3.2.2]nona-1(7),5,8-trien-3-one; 1-iodanylprop-1-yne Openeye Name: 6-ethyl-2,4-dioxabicyclo[3.2.2]nona-1(7),5,8-trien-3-one; 1-iodoprop-1-yne CAS Name: 6-ethyl-2,4-dioxabicyclo[3.2.2]nona-1(7),5,8-trien-3-one; 1-iodo-1-propyne IUPAC Name: 6-ethyl-2,4-dioxabicyclo[3.2.2]nona-1(7),5,8-trien-3-one; 1-iodoprop-1-yne Traditional Name: 6-ethyl-2,4-dioxabicyclo[3.2.2]nona-1(7),5,8-trien-3-one; 1-iodoprop-1-yne Formula: C12H11IO3 MolecularWeight: 330.11841

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C=CC(=C1)OC(=O)O2.CC#CI

Isomeric SMILES

CCC1=C2C=CC(=C1)OC(=O)O2.CC#CI

InChI

InChI=1S/C9H8O3.C3H3I/c1-2-6-5-7-3-4-8(6)12-9(10)11-7;1-2-3-4/h3-5H,2H2,1H3;1H3