3-iodanyloctan-2-yl ethanoate

Systemtic Name: 3-iodanyloctan-2-yl ethanoate Openeye Name: (2-iodo-1-methyl-heptyl) acetate CAS Name: acetic acid 3-iodooctan-2-yl ester IUPAC Name: 3-iodooctan-2-yl acetate Traditional Name: acetic acid (2-iodo-1-methyl-heptyl) ester Formula: C10H19IO2 MolecularWeight: 298.16113

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C(C)OC(=O)C)I

Isomeric SMILES

CCCCCC(C(C)OC(=O)C)I

InChI

InChI=1S/C10H19IO2/c1-4-5-6-7-10(11)8(2)13-9(3)12/h8,10H,4-7H2,1-3H3