[3-(3-chloranylpropanoyl)-2,6-dimethyl-phenyl] ethanoate

Systemtic Name: [3-(3-chloranylpropanoyl)-2,6-dimethyl-phenyl] ethanoate Openeye Name: [3-(3-chloropropanoyl)-2,6-dimethyl-phenyl] acetate CAS Name: acetic acid [3-(3-chloro-1-oxopropyl)-2,6-dimethylphenyl] ester IUPAC Name: [3-(3-chloropropanoyl)-2,6-dimethylphenyl] acetate Traditional Name: acetic acid [3-(3-chloropropanoyl)-2,6-dimethyl-phenyl] ester Formula: C13H15ClO3 MolecularWeight: 254.7094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C(=O)CCCl)C)OC(=O)C

Isomeric SMILES

CC1=C(C(=C(C=C1)C(=O)CCCl)C)OC(=O)C

InChI

InChI=1S/C13H15ClO3/c1-8-4-5-11(12(16)6-7-14)9(2)13(8)17-10(3)15/h4-5H,6-7H2,1-3H3