5-(4-chlorophenyl)-2-ethanoyl-cyclohexane-1,3-dione

Systemtic Name: 5-(4-chlorophenyl)-2-ethanoyl-cyclohexane-1,3-dione Openeye Name: 2-acetyl-5-(4-chlorophenyl)cyclohexane-1,3-dione CAS Name: 2-acetyl-5-(4-chlorophenyl)cyclohexane-1,3-dione IUPAC Name: 2-acetyl-5-(4-chlorophenyl)cyclohexane-1,3-dione Traditional Name: 2-acetyl-5-(4-chlorophenyl)cyclohexane-1,3-quinone Formula: C14H13ClO3 MolecularWeight: 264.70422

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1C(=O)CC(CC1=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(=O)C1C(=O)CC(CC1=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C14H13ClO3/c1-8(16)14-12(17)6-10(7-13(14)18)9-2-4-11(15)5-3-9/h2-5,10,14H,6-7H2,1H3