[2-[2,5-bis(chloranyl)phenyl]-5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl] ethanoate

Systemtic Name: [2-[2,5-bis(chloranyl)phenyl]-5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl] ethanoate Openeye Name: [2-(2,5-dichlorophenyl)-5,5-dimethyl-3-oxo-cyclohexen-1-yl] acetate CAS Name: acetic acid [2-(2,5-dichlorophenyl)-5,5-dimethyl-3-oxo-1-cyclohexenyl] ester IUPAC Name: [2-(2,5-dichlorophenyl)-5,5-dimethyl-3-oxocyclohexen-1-yl] acetate Traditional Name: acetic acid [2-(2,5-dichlorophenyl)-3-keto-5,5-dimethyl-cyclohexen-1-yl] ester Formula: C16H16Cl2O3 MolecularWeight: 327.20244

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C(=O)CC(C1)(C)C)C2=C(C=CC(=C2)Cl)Cl

Isomeric SMILES

CC(=O)OC1=C(C(=O)CC(C1)(C)C)C2=C(C=CC(=C2)Cl)Cl

InChI

InChI=1S/C16H16Cl2O3/c1-9(19)21-14-8-16(2,3)7-13(20)15(14)11-6-10(17)4-5-12(11)18/h4-6H,7-8H2,1-3H3