2-methylbutyl 2-fluoranyl-4-iodanyl-benzoate

Systemtic Name: 2-methylbutyl 2-fluoranyl-4-iodanyl-benzoate Openeye Name: 2-methylbutyl 2-fluoro-4-iodo-benzoate CAS Name: 2-fluoro-4-iodobenzoic acid 2-methylbutyl ester IUPAC Name: 2-methylbutyl 2-fluoro-4-iodobenzoate Traditional Name: 2-fluoro-4-iodo-benzoic acid 2-methylbutyl ester Formula: C12H14FIO2 MolecularWeight: 336.141233

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)COC(=O)C1=C(C=C(C=C1)I)F

Isomeric SMILES

CCC(C)COC(=O)C1=C(C=C(C=C1)I)F

InChI

InChI=1S/C12H14FIO2/c1-3-8(2)7-16-12(15)10-5-4-9(14)6-11(10)13/h4-6,8H,3,7H2,1-2H3