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3-Methoxy-N-methyldesloratadine-[d4]

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General Information
Catalog: BLP-002770
CAS: 1189445-21-3
Molecular Formula: C21H19D4ClN2O
Molecular Weight: 358.90

Chemical Structure

Description	3-Methoxy-N-methyldesloratadine-[d4] is the labelled analogue of 3-Methoxy-N-methyldesloratadine, which is an impurity of Desloratadine.
Synonyms	3-Methoxy-N-methyldesloratadine D4; 3-Methoxy-N-methyldesloratadine-d4
IUPAC Name	13-chloro-6-methoxy-2-(2,2,6,6-tetradeuterio-1-methylpiperidin-4-ylidene)-4-azatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaene
Related CAS	165739-72-0 (unlabelled)
Isomeric SMILES	[2H]C1(CC(=C2C3=C(CCC4=C2N=CC(=C4)OC)C=C(C=C3)Cl)CC(N1C)([2H])[2H])[2H]
Canonical SMILES	CN1CCC(=C2C3=C(CCC4=C2N=CC(=C4)OC)C=C(C=C3)Cl)CC1
InChI	InChI=1S/C21H23ClN2O/c1-24-9-7-14(8-10-24)20-19-6-5-17(22)11-15(19)3-4-16-12-18(25-2)13-23-21(16)20/h5-6,11-13H,3-4,7-10H2,1-2H3/i9D2,10D2
InChI Key	ONYKRGLBQBBZDH-YQUBHJMPSA-N
Purity	> 98%
Solubility	Soluble in Chloroform, Dichloromethane, Ethyl Acetate, Methanol
Appearance	Brown Solid