5-(4-chlorophenyl)-5-methyl-cyclohexane-1,3-dione

Systemtic Name: 5-(4-chlorophenyl)-5-methyl-cyclohexane-1,3-dione Openeye Name: 5-(4-chlorophenyl)-5-methyl-cyclohexane-1,3-dione CAS Name: 5-(4-chlorophenyl)-5-methylcyclohexane-1,3-dione IUPAC Name: 5-(4-chlorophenyl)-5-methylcyclohexane-1,3-dione Traditional Name: 5-(4-chlorophenyl)-5-methyl-cyclohexane-1,3-quinone Formula: C13H13ClO2 MolecularWeight: 236.69412

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)CC(=O)C1)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC1(CC(=O)CC(=O)C1)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C13H13ClO2/c1-13(7-11(15)6-12(16)8-13)9-2-4-10(14)5-3-9/h2-5H,6-8H2,1H3