(4-iodophenyl) 3,3-dimethylbutanoate

Systemtic Name: (4-iodophenyl) 3,3-dimethylbutanoate Openeye Name: (4-iodophenyl) 3,3-dimethylbutanoate CAS Name: 3,3-dimethylbutanoic acid (4-iodophenyl) ester IUPAC Name: (4-iodophenyl) 3,3-dimethylbutanoate Traditional Name: 3,3-dimethylbutyric acid (4-iodophenyl) ester Formula: C12H15IO2 MolecularWeight: 318.15077

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)OC1=CC=C(C=C1)I

Isomeric SMILES

CC(C)(C)CC(=O)OC1=CC=C(C=C1)I

InChI

InChI=1S/C12H15IO2/c1-12(2,3)8-11(14)15-10-6-4-9(13)5-7-10/h4-7H,8H2,1-3H3