(4-chloranyl-1-oxidanylidene-1-phenyl-pent-4-en-2-yl) ethanoate

Systemtic Name: (4-chloranyl-1-oxidanylidene-1-phenyl-pent-4-en-2-yl) ethanoate Openeye Name: (1-benzoyl-3-chloro-but-3-enyl) acetate CAS Name: acetic acid (4-chloro-1-oxo-1-phenylpent-4-en-2-yl) ester IUPAC Name: (4-chloro-1-oxo-1-phenylpent-4-en-2-yl) acetate Traditional Name: acetic acid (1-benzoyl-3-chloro-but-3-enyl) ester Formula: C13H13ClO3 MolecularWeight: 252.69352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13ClO3/c1-9(14)8-12(17-10(2)15)13(16)11-6-4-3-5-7-11/h3-7,12H,1,8H2,2H3