Products 1254576-93-6

CAS 1254576-93-6 is the registry number for Diclofenac 2,5-Quinone Imine. Offered by: Chemat Brand, TRC. Available pack sizes: on request, 100mg.

Structural formula: {0} (CAS {1})

5-hydroxydiclofenac quinone imine is a quinone imine that is a metabolite of diclofenac arising from 5-hydroxylation followed by oxidation. It has a role as a drug metabolite. It is a dichlorobenzene, a monocarboxylic acid and a quinone imine. It is functionally related to a diclofenac.

Source: ChEBI

Identity
Molecular formulaC14H9Cl2NO3
Molecular weight310.1 g/mol
IUPAC name2-[6-(2,6-dichlorophenyl)imino-3-oxocyclohexa-1,4-dien-1-yl]acetic acid
InChIKeyGTSUHSLLLCOPRM-UHFFFAOYSA-N
SMILESC1=CC(=C(C(=C1)Cl)N=C2C=CC(=O)C=C2CC(=O)O)Cl

Computed by PubChem (NCBI)