5-tert-butyl-4-iodanyl-benzene-1,2,3-triol

Systemtic Name: 5-tert-butyl-4-iodanyl-benzene-1,2,3-triol Openeye Name: 5-tert-butyl-4-iodo-benzene-1,2,3-triol CAS Name: 5-tert-butyl-4-iodobenzene-1,2,3-triol IUPAC Name: 5-tert-butyl-4-iodobenzene-1,2,3-triol Traditional Name: 5-tert-butyl-4-iodo-pyrogallol Formula: C10H13IO3 MolecularWeight: 308.11289

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C(=C1I)O)O)O

Isomeric SMILES

CC(C)(C)C1=CC(=C(C(=C1I)O)O)O

InChI

InChI=1S/C10H13IO3/c1-10(2,3)5-4-6(12)8(13)9(14)7(5)11/h4,12-14H,1-3H3