(3,3-dimethyl-2-oxidanylidene-butyl) 5-iodanyl-2-oxidanyl-benzoate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 5-iodanyl-2-oxidanyl-benzoate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 2-hydroxy-5-iodo-benzoate CAS Name: 2-hydroxy-5-iodobenzoic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 2-hydroxy-5-iodobenzoate Traditional Name: 2-hydroxy-5-iodo-benzoic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C13H15IO4 MolecularWeight: 362.16027

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15IO4/c1-13(2,3)11(16)7-18-12(17)9-6-8(14)4-5-10(9)15/h4-6,15H,7H2,1-3H3