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Haloperidol N-Oxide-[d4]

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General Information
Catalog: BLP-013034
CAS: 1246815-56-4
Molecular Formula: C21H19D4ClFNO3
Molecular Weight: 395.89

Chemical Structure

Description	Haloperidol N-Oxide-[d4] is the labelled analogue of Haloperidol N-Oxide, which is a metabolite of Haloperidol.
Synonyms	Haloperidol-d4 N-Oxide; 4-[4-(4-Chlorophenyl-d4)-4-hydroxy-1-oxido-1-piperidinyl]-1-(4-fluorophenyl)-1-butanone; 4-[4-(4-Chlorophenyl-d4)-4-hydroxy-1-piperidinyl]-1-(4-fluorophenyl)-1-butanone N-Oxide
IUPAC Name	4-[4-(4-chloro-2,3,5,6-tetradeuteriophenyl)-4-hydroxy-1-oxidopiperidin-1-ium-1-yl]-1-(4-fluorophenyl)butan-1-one
Related CAS	148406-51-3 (unlabelled)
Canonical SMILES	C1C[N+](CCC1(C2=CC=C(C=C2)Cl)O)(CCCC(=O)C3=CC=C(C=C3)F)[O-]
InChI	InChI=1S/C21H23ClFNO3/c22-18-7-5-17(6-8-18)21(26)11-14-24(27,15-12-21)13-1-2-20(25)16-3-9-19(23)10-4-16/h3-10,26H,1-2,11-15H2/i5D,6D,7D,8D
InChI Key	LDKZFGVWYVWUSG-KDWZCNHSSA-N
Purity	>95%