methyl 2-[7-(3-bromanylpropyl)-6-iodanyl-oxepan-2-yl]ethanoate

Systemtic Name: methyl 2-[7-(3-bromanylpropyl)-6-iodanyl-oxepan-2-yl]ethanoate Openeye Name: methyl 2-[7-(3-bromopropyl)-6-iodo-oxepan-2-yl]acetate CAS Name: 2-[7-(3-bromopropyl)-6-iodo-2-oxepanyl]acetic acid methyl ester IUPAC Name: methyl 2-[7-(3-bromopropyl)-6-iodooxepan-2-yl]acetate Traditional Name: 2-[7-(3-bromopropyl)-6-iodo-oxepan-2-yl]acetic acid methyl ester Formula: C12H20BrIO3 MolecularWeight: 419.09387

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1CCCC(C(O1)CCCBr)I

Isomeric SMILES

COC(=O)CC1CCCC(C(O1)CCCBr)I

InChI

InChI=1S/C12H20BrIO3/c1-16-12(15)8-9-4-2-5-10(14)11(17-9)6-3-7-13/h9-11H,2-8H2,1H3