(6-iodanyl-1,3-benzodioxol-5-yl) ethanoate

Systemtic Name: (6-iodanyl-1,3-benzodioxol-5-yl) ethanoate Openeye Name: (6-iodo-1,3-benzodioxol-5-yl) acetate CAS Name: acetic acid (6-iodo-1,3-benzodioxol-5-yl) ester IUPAC Name: (6-iodo-1,3-benzodioxol-5-yl) acetate Traditional Name: acetic acid (6-iodo-1,3-benzodioxol-5-yl) ester Formula: C9H7IO4 MolecularWeight: 306.05395

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C2C(=C1)OCO2)I

Isomeric SMILES

CC(=O)OC1=C(C=C2C(=C1)OCO2)I

InChI

InChI=1S/C9H7IO4/c1-5(11)14-7-3-9-8(2-6(7)10)12-4-13-9/h2-3H,4H2,1H3