(3,5-diethyl-4-iodanyl-phenyl) ethanoate

Systemtic Name: (3,5-diethyl-4-iodanyl-phenyl) ethanoate Openeye Name: (3,5-diethyl-4-iodo-phenyl) acetate CAS Name: acetic acid (3,5-diethyl-4-iodophenyl) ester IUPAC Name: (3,5-diethyl-4-iodophenyl) acetate Traditional Name: acetic acid (3,5-diethyl-4-iodo-phenyl) ester Formula: C12H15IO2 MolecularWeight: 318.15077

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC(=C1I)CC)OC(=O)C

Isomeric SMILES

CCC1=CC(=CC(=C1I)CC)OC(=O)C

InChI

InChI=1S/C12H15IO2/c1-4-9-6-11(15-8(3)14)7-10(5-2)12(9)13/h6-7H,4-5H2,1-3H3