hexyl 4-iodanyl-3-oxidanyl-butanoate

Systemtic Name: hexyl 4-iodanyl-3-oxidanyl-butanoate Openeye Name: hexyl 3-hydroxy-4-iodo-butanoate CAS Name: 3-hydroxy-4-iodobutanoic acid hexyl ester IUPAC Name: hexyl 3-hydroxy-4-iodobutanoate Traditional Name: 3-hydroxy-4-iodo-butyric acid hexyl ester Formula: C10H19IO3 MolecularWeight: 314.16053

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)CC(CI)O

Isomeric SMILES

CCCCCCOC(=O)CC(CI)O

InChI

InChI=1S/C10H19IO3/c1-2-3-4-5-6-14-10(13)7-9(12)8-11/h9,12H,2-8H2,1H3