propan-2-one; [2,2,2-tris(chloranyl)-1-phenyl-ethyl] ethanoate

Systemtic Name: propan-2-one; [2,2,2-tris(chloranyl)-1-phenyl-ethyl] ethanoate Openeye Name: acetone; (2,2,2-trichloro-1-phenyl-ethyl) acetate CAS Name: acetic acid (2,2,2-trichloro-1-phenylethyl) ester; 2-propanone IUPAC Name: propan-2-one; (2,2,2-trichloro-1-phenylethyl) acetate Traditional Name: acetic acid (2,2,2-trichloro-1-phenyl-ethyl) ester; acetone Formula: C13H15Cl3O3 MolecularWeight: 325.6154

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H9Cl3O2.C3H6O/c1-7(14)15-9(10(11,12)13)8-5-3-2-4-6-8;1-3(2)4/h2-6,9H,1H3;1-2H3