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

Systemtic Name: 2-[2-(4-chloranyl-3-methyl-phenyl)-2-oxidanylidene-ethyl]-5,5-dimethyl-cyclohexane-1,3-dione Openeye Name: 2-[2-(4-chloro-3-methyl-phenyl)-2-oxo-ethyl]-5,5-dimethyl-cyclohexane-1,3-dione CAS Name: 2-[2-(4-chloro-3-methylphenyl)-2-oxoethyl]-5,5-dimethylcyclohexane-1,3-dione IUPAC Name: 2-[2-(4-chloro-3-methylphenyl)-2-oxoethyl]-5,5-dimethylcyclohexane-1,3-dione Traditional Name: 2-[2-(4-chloro-3-methyl-phenyl)-2-keto-ethyl]-5,5-dimethyl-cyclohexane-1,3-quinone Formula: C17H19ClO3 MolecularWeight: 306.78396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)CC2C(=O)CC(CC2=O)(C)C)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)CC2C(=O)CC(CC2=O)(C)C)Cl

InChI

InChI=1S/C17H19ClO3/c1-10-6-11(4-5-13(10)18)14(19)7-12-15(20)8-17(2,3)9-16(12)21/h4-6,12H,7-9H2,1-3H3