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Azelastine N-Oxide-[13C,d3]

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General Information
Catalog: BLP-003377
CAS: 1346602-76-3
Molecular Formula: C21[13C]H21D3ClN3O2
Molecular Weight: 401.91

Chemical Structure

Description	Azelastine N-Oxide-[13C,d3] is a labelled metabolite of Azelastine.
Synonyms	4-[(4-chlorophenyl)methyl]-2-[1-oxido-1-(trideuteriomethyl)azepan-1-ium-4-yl]phthalazin-1-one
IUPAC Name	4-[(4-chlorophenyl)methyl]-2-[1-oxido-1-(trideuterio(1-13C)methyl)azepan-1-ium-4-yl]phthalazin-1-one
Related CAS	640279-88-5 (unlabelled)
Canonical SMILES	C[N+]1(CCCC(CC1)N2C(=O)C3=CC=CC=C3C(=N2)CC4=CC=C(C=C4)Cl)[O-]
InChI	InChI=1S/C22H24ClN3O2/c1-26(28)13-4-5-18(12-14-26)25-22(27)20-7-3-2-6-19(20)21(24-25)15-16-8-10-17(23)11-9-16/h2-3,6-11,18H,4-5,12-15H2,1H3/i1+1D3
InChI Key	QFWLGALGCDUDAP-KQORAOOSSA-N
Melting Point	148-150°C
Purity	> 98%
Solubility	Soluble in Chloroform, Methanol
Appearance	White Solid
Storage	-20°C