[(3R,6R)-6-butyl-5-iodanyl-4-methyl-3,6-dihydro-2H-pyran-3-yl] ethanoate

Systemtic Name: [(3R,6R)-6-butyl-5-iodanyl-4-methyl-3,6-dihydro-2H-pyran-3-yl] ethanoate Openeye Name: [(3R,6R)-6-butyl-5-iodo-4-methyl-3,6-dihydro-2H-pyran-3-yl] acetate CAS Name: acetic acid [(3R,6R)-6-butyl-5-iodo-4-methyl-3,6-dihydro-2H-pyran-3-yl] ester IUPAC Name: [(3R,6R)-6-butyl-5-iodo-4-methyl-3,6-dihydro-2H-pyran-3-yl] acetate Traditional Name: acetic acid [(3R,6R)-6-butyl-5-iodo-4-methyl-3,6-dihydro-2H-pyran-3-yl] ester Formula: C12H19IO3 MolecularWeight: 338.18193

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C(=C(C(CO1)OC(=O)C)C)I

Isomeric SMILES

CCCC[C@@H]1C(=C([C@H](CO1)OC(=O)C)C)I

InChI

InChI=1S/C12H19IO3/c1-4-5-6-10-12(13)8(2)11(7-15-10)16-9(3)14/h10-11H,4-7H2,1-3H3/t10-,11+/m1/s1