2-[(2-chloranyl-6-fluoranyl-phenyl)-(4,4-dimethyl-2-oxidanyl-6-oxidanylidene-cyclohexen-1-yl)methyl]-5,5-dimethyl-cyclohexane-1,3-dione

Systemtic Name: 2-[(2-chloranyl-6-fluoranyl-phenyl)-(4,4-dimethyl-2-oxidanyl-6-oxidanylidene-cyclohexen-1-yl)methyl]-5,5-dimethyl-cyclohexane-1,3-dione Openeye Name: 2-[(2-chloro-6-fluoro-phenyl)-(2-hydroxy-4,4-dimethyl-6-oxo-cyclohexen-1-yl)methyl]-5,5-dimethyl-cyclohexane-1,3-dione CAS Name: 2-[(2-chloro-6-fluorophenyl)-(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexenyl)methyl]-5,5-dimethylcyclohexane-1,3-dione IUPAC Name: 2-[(2-chloro-6-fluorophenyl)-(2-hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)methyl]-5,5-dimethylcyclohexane-1,3-dione Traditional Name: 2-[(2-chloro-6-fluoro-phenyl)-(2-hydroxy-6-keto-4,4-dimethyl-cyclohexen-1-yl)methyl]-5,5-dimethyl-cyclohexane-1,3-quinone Formula: C23H26ClFO4 MolecularWeight: 420.901543

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(C(=O)C1)C(C2=C(CC(CC2=O)(C)C)O)C3=C(C=CC=C3Cl)F)C

Isomeric SMILES

CC1(CC(=O)C(C(=O)C1)C(C2=C(CC(CC2=O)(C)C)O)C3=C(C=CC=C3Cl)F)C

InChI

InChI=1S/C23H26ClFO4/c1-22(2)8-14(26)19(15(27)9-22)21(18-12(24)6-5-7-13(18)25)20-16(28)10-23(3,4)11-17(20)29/h5-7,19,21,28H,8-11H2,1-4H3