2-[2-(4-fluoranyl-3-methyl-phenyl)-2-oxidanylidene-ethyl]-2,5,5-trimethyl-cyclohexane-1,3-dione

Systemtic Name: 2-[2-(4-fluoranyl-3-methyl-phenyl)-2-oxidanylidene-ethyl]-2,5,5-trimethyl-cyclohexane-1,3-dione Openeye Name: 2-[2-(4-fluoro-3-methyl-phenyl)-2-oxo-ethyl]-2,5,5-trimethyl-cyclohexane-1,3-dione CAS Name: 2-[2-(4-fluoro-3-methylphenyl)-2-oxoethyl]-2,5,5-trimethylcyclohexane-1,3-dione IUPAC Name: 2-[2-(4-fluoro-3-methylphenyl)-2-oxoethyl]-2,5,5-trimethylcyclohexane-1,3-dione Traditional Name: 2-[2-(4-fluoro-3-methyl-phenyl)-2-keto-ethyl]-2,5,5-trimethyl-cyclohexane-1,3-quinone Formula: C18H21FO3 MolecularWeight: 304.355943

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)CC2(C(=O)CC(CC2=O)(C)C)C)F

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)CC2(C(=O)CC(CC2=O)(C)C)C)F

InChI

InChI=1S/C18H21FO3/c1-11-7-12(5-6-13(11)19)14(20)8-18(4)15(21)9-17(2,3)10-16(18)22/h5-7H,8-10H2,1-4H3