tert-butyl 5-chloranyl-2-iodanyl-benzoate

Systemtic Name: tert-butyl 5-chloranyl-2-iodanyl-benzoate Openeye Name: tert-butyl 5-chloro-2-iodo-benzoate CAS Name: 5-chloro-2-iodobenzoic acid tert-butyl ester IUPAC Name: tert-butyl 5-chloro-2-iodobenzoate Traditional Name: 5-chloro-2-iodo-benzoic acid tert-butyl ester Formula: C11H12ClIO2 MolecularWeight: 338.56925

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12ClIO2/c1-11(2,3)15-10(14)8-6-7(12)4-5-9(8)13/h4-6H,1-3H3