[2-cyano-1-(2-iodanylphenyl)-2-methyl-propyl] ethanoate

Systemtic Name: [2-cyano-1-(2-iodanylphenyl)-2-methyl-propyl] ethanoate Openeye Name: [2-cyano-1-(2-iodophenyl)-2-methyl-propyl] acetate CAS Name: acetic acid [2-cyano-1-(2-iodophenyl)-2-methylpropyl] ester IUPAC Name: [2-cyano-1-(2-iodophenyl)-2-methylpropyl] acetate Traditional Name: acetic acid [2-cyano-1-(2-iodophenyl)-2-methyl-propyl] ester Formula: C13H14INO2 MolecularWeight: 343.16023

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C1=CC=CC=C1I)C(C)(C)C#N

Isomeric SMILES

CC(=O)OC(C1=CC=CC=C1I)C(C)(C)C#N

InChI

InChI=1S/C13H14INO2/c1-9(16)17-12(13(2,3)8-15)10-6-4-5-7-11(10)14/h4-7,12H,1-3H3