2-[2,4-bis(oxidanylidene)pentan-3-yl]-5-(4-chlorophenyl)cyclohexane-1,3-dione

Systemtic Name: 2-[2,4-bis(oxidanylidene)pentan-3-yl]-5-(4-chlorophenyl)cyclohexane-1,3-dione Openeye Name: 2-(1-acetyl-2-oxo-propyl)-5-(4-chlorophenyl)cyclohexane-1,3-dione CAS Name: 5-(4-chlorophenyl)-2-(2,4-dioxopentan-3-yl)cyclohexane-1,3-dione IUPAC Name: 5-(4-chlorophenyl)-2-(2,4-dioxopentan-3-yl)cyclohexane-1,3-dione Traditional Name: 2-(1-acetyl-2-keto-propyl)-5-(4-chlorophenyl)cyclohexane-1,3-quinone Formula: C17H17ClO4 MolecularWeight: 320.76748

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17ClO4/c1-9(19)16(10(2)20)17-14(21)7-12(8-15(17)22)11-3-5-13(18)6-4-11/h3-6,12,16-17H,7-8H2,1-2H3