Products 1000590-53-3

CAS 1000590-53-3 is the registry number for COX-2-IN-56. Offered by: MedChemExpress. Available pack sizes: Get quote.

COX-2-IN-56
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2-[2-(2,4-dichloro-3-methylanilino)-5-methylphenyl]acetic acid (CAS 1000590-53-3) is a chemical compound with the molecular formula C16H15Cl2NO2 and a molecular weight of 324.2 g/mol. IUPAC name: 2-[2-(2,4-dichloro-3-methylanilino)-5-methylphenyl]acetic acid. InChIKey: BSCGZOZNKPEXSS-UHFFFAOYSA-N.

Identity
Molecular formulaC16H15Cl2NO2
Molecular weight324.2 g/mol
IUPAC name2-[2-(2,4-dichloro-3-methylanilino)-5-methylphenyl]acetic acid
InChIKeyBSCGZOZNKPEXSS-UHFFFAOYSA-N
SMILESCC1=CC(=C(C=C1)NC2=C(C(=C(C=C2)Cl)C)Cl)CC(=O)O

Computed by PubChem (NCBI)

Synonyms: orb3136553, BSCGZOZNKPEXSS-UHFFFAOYSA-N, 5-Methyl-2-(2',4'-dichloro-3'-methylanilino)phenylacetic acid, 2-(2-((2,4-Dichloro-3-methylphenyl)amino)-5-methylphenyl)acetic acid
Isomers (same molecular formula)
ethyl 2-[2-(2,6-dichloroanilino)phenyl]acetate C16H15Cl2NO2
[(2R)-4-benzyl-6,8-dichloro-2,3-dihydro-1,4-benzoxazin-2-yl]methanol C16H15Cl2NO2
2-(2,4-dichloro-3-methylphenoxy)-N-phenylpropanamide C16H15Cl2NO2
4-[1-(2,5-dichlorophenyl)ethylamino]-3-methylbenzoic acid C16H15Cl2NO2

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