tert-butyl 5-iodanyl-2-(3-methylbutoxy)benzoate

Systemtic Name: tert-butyl 5-iodanyl-2-(3-methylbutoxy)benzoate Openeye Name: tert-butyl 5-iodo-2-isopentyloxy-benzoate CAS Name: 5-iodo-2-(3-methylbutoxy)benzoic acid tert-butyl ester IUPAC Name: tert-butyl 5-iodo-2-(3-methylbutoxy)benzoate Traditional Name: 5-iodo-2-isoamoxy-benzoic acid tert-butyl ester Formula: C16H23IO3 MolecularWeight: 390.25649

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1)I)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1)I)C(=O)OC(C)(C)C

InChI

InChI=1S/C16H23IO3/c1-11(2)8-9-19-14-7-6-12(17)10-13(14)15(18)20-16(3,4)5/h6-7,10-11H,8-9H2,1-5H3