[2-(2,4-dichlorophenyl)-5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl] 2-ethylhexanoate

Systemtic Name: [2-(2,4-dichlorophenyl)-5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl] 2-ethylhexanoate Openeye Name: [2-(2,4-dichlorophenyl)-5,5-dimethyl-3-oxo-cyclohexen-1-yl] 2-ethylhexanoate CAS Name: 2-ethylhexanoic acid [2-(2,4-dichlorophenyl)-5,5-dimethyl-3-oxo-1-cyclohexenyl] ester IUPAC Name: [2-(2,4-dichlorophenyl)-5,5-dimethyl-3-oxocyclohexen-1-yl] 2-ethylhexanoate Traditional Name: 2-ethylhexanoic acid [2-(2,4-dichlorophenyl)-3-keto-5,5-dimethyl-cyclohexen-1-yl] ester Formula: C22H28Cl2O3 MolecularWeight: 411.36192

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28Cl2O3/c1-5-7-8-14(6-2)21(26)27-19-13-22(3,4)12-18(25)20(19)16-10-9-15(23)11-17(16)24/h9-11,14H,5-8,12-13H2,1-4H3