(1-chloranyl-1-iodanyl-3-phenyl-butan-2-yl) ethanoate

Systemtic Name: (1-chloranyl-1-iodanyl-3-phenyl-butan-2-yl) ethanoate Openeye Name: [1-[chloro(iodo)methyl]-2-phenyl-propyl] acetate CAS Name: acetic acid (1-chloro-1-iodo-3-phenylbutan-2-yl) ester IUPAC Name: (1-chloro-1-iodo-3-phenylbutan-2-yl) acetate Traditional Name: acetic acid [1-[chloro(iodo)methyl]-2-phenyl-propyl] ester Formula: C12H14ClIO2 MolecularWeight: 352.59583

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)C(C(Cl)I)OC(=O)C

Isomeric SMILES

CC(C1=CC=CC=C1)C(C(Cl)I)OC(=O)C

InChI

InChI=1S/C12H14ClIO2/c1-8(10-6-4-3-5-7-10)11(12(13)14)16-9(2)15/h3-8,11-12H,1-2H3