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N-Trifluoroacetodesmethyl Citalopram-[d3]

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General Information
Catalog: BLP-003603
CAS: 1189981-17-6
Molecular Formula: C21H15D3F4N2O2
Molecular Weight: 409.39

Chemical Structure

Synonyms	N-Trifluoroacetodesmethyl Citalopram D3
IUPAC Name	N-[3-[5-cyano-1-(4-fluorophenyl)-3H-2-benzofuran-1-yl]propyl]-2,2,2-trifluoro-N-(trideuteriomethyl)acetamide
Related CAS	1076199-46-6 (unlabelled)
Canonical SMILES	CN(CCCC1(C2=C(CO1)C=C(C=C2)C#N)C3=CC=C(C=C3)F)C(=O)C(F)(F)F
InChI	InChI=1S/C21H18F4N2O2/c1-27(19(28)21(23,24)25)10-2-9-20(16-4-6-17(22)7-5-16)18-8-3-14(12-26)11-15(18)13-29-20/h3-8,11H,2,9-10,13H2,1H3/i1D3
InChI Key	AIVUSJIHPDCSPS-FIBGUPNXSA-N
Solubility	Soluble in Acetone, Dichloromethane, Ethyl Acetate
Appearance	Pale Yellow Oil
Storage	Store at 2-8°C