[1-(2-chlorophenyl)-2-methylidene-3-oxidanylidene-butyl] ethanoate

Systemtic Name: [1-(2-chlorophenyl)-2-methylidene-3-oxidanylidene-butyl] ethanoate Openeye Name: [1-(2-chlorophenyl)-2-methylene-3-oxo-butyl] acetate CAS Name: acetic acid [1-(2-chlorophenyl)-2-methylene-3-oxobutyl] ester IUPAC Name: [1-(2-chlorophenyl)-2-methylidene-3-oxobutyl] acetate Traditional Name: acetic acid [2-acetyl-1-(2-chlorophenyl)allyl] ester Formula: C13H13ClO3 MolecularWeight: 252.69352

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=C)C(C1=CC=CC=C1Cl)OC(=O)C

Isomeric SMILES

CC(=O)C(=C)C(C1=CC=CC=C1Cl)OC(=O)C

InChI

InChI=1S/C13H13ClO3/c1-8(9(2)15)13(17-10(3)16)11-6-4-5-7-12(11)14/h4-7,13H,1H2,2-3H3