3-heptyl-6-(2-iodanylpropan-2-yl)-1,2,4-trioxane

Systemtic Name: 3-heptyl-6-(2-iodanylpropan-2-yl)-1,2,4-trioxane Openeye Name: 3-heptyl-6-(1-iodo-1-methyl-ethyl)-1,2,4-trioxane CAS Name: 3-heptyl-6-(2-iodopropan-2-yl)-1,2,4-trioxane IUPAC Name: 3-heptyl-6-(2-iodopropan-2-yl)-1,2,4-trioxane Traditional Name: 3-heptyl-6-(1-iodo-1-methyl-ethyl)-1,2,4-trioxane Formula: C13H25IO3 MolecularWeight: 356.24027

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1OCC(OO1)C(C)(C)I

Isomeric SMILES

CCCCCCCC1OCC(OO1)C(C)(C)I

InChI

InChI=1S/C13H25IO3/c1-4-5-6-7-8-9-12-15-10-11(16-17-12)13(2,3)14/h11-12H,4-10H2,1-3H3