2,4-dimethyl-4-(trichloromethyl)cyclohexa-2,5-dien-1-one

Systemtic Name: 2,4-dimethyl-4-(trichloromethyl)cyclohexa-2,5-dien-1-one Openeye Name: 2,4-dimethyl-4-(trichloromethyl)cyclohexa-2,5-dien-1-one CAS Name: 2,4-dimethyl-4-(trichloromethyl)-1-cyclohexa-2,5-dienone IUPAC Name: 2,4-dimethyl-4-(trichloromethyl)cyclohexa-2,5-dien-1-one Traditional Name: 2,4-dimethyl-4-(trichloromethyl)cyclohexa-2,5-dien-1-one Formula: C9H9Cl3O MolecularWeight: 239.52616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(C=CC1=O)(C)C(Cl)(Cl)Cl

Isomeric SMILES

CC1=CC(C=CC1=O)(C)C(Cl)(Cl)Cl

InChI

InChI=1S/C9H9Cl3O/c1-6-5-8(2,9(10,11)12)4-3-7(6)13/h3-5H,1-2H3