[(E,2S)-1,1,1-tris(chloranyl)-4-phenyl-but-3-en-2-yl] ethanoate

Systemtic Name: [(E,2S)-1,1,1-tris(chloranyl)-4-phenyl-but-3-en-2-yl] ethanoate Openeye Name: [(E,1S)-3-phenyl-1-(trichloromethyl)allyl] acetate CAS Name: acetic acid [(E,2S)-1,1,1-trichloro-4-phenylbut-3-en-2-yl] ester IUPAC Name: [(E,2S)-1,1,1-trichloro-4-phenylbut-3-en-2-yl] acetate Traditional Name: acetic acid [(E,1S)-3-phenyl-1-(trichloromethyl)allyl] ester Formula: C12H11Cl3O2 MolecularWeight: 293.57354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C=CC1=CC=CC=C1)C(Cl)(Cl)Cl

Isomeric SMILES

CC(=O)O[C@@H](/C=C/C1=CC=CC=C1)C(Cl)(Cl)Cl

InChI

InChI=1S/C12H11Cl3O2/c1-9(16)17-11(12(13,14)15)8-7-10-5-3-2-4-6-10/h2-8,11H,1H3/b8-7+/t11-/m0/s1