tert-butyl 5-iodanyl-2-oxidanyl-benzoate

Systemtic Name: tert-butyl 5-iodanyl-2-oxidanyl-benzoate Openeye Name: tert-butyl 2-hydroxy-5-iodo-benzoate CAS Name: 2-hydroxy-5-iodobenzoic acid tert-butyl ester IUPAC Name: tert-butyl 2-hydroxy-5-iodobenzoate Traditional Name: 2-hydroxy-5-iodo-benzoic acid tert-butyl ester Formula: C11H13IO3 MolecularWeight: 320.12359

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=C(C=CC(=C1)I)O

Isomeric SMILES

CC(C)(C)OC(=O)C1=C(C=CC(=C1)I)O

InChI

InChI=1S/C11H13IO3/c1-11(2,3)15-10(14)8-6-7(12)4-5-9(8)13/h4-6,13H,1-3H3