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Doxepin-[d3] Hydrochloride

General Information
Catalog: BLP-008143
CAS: 347840-07-7
Molecular Formula: C19H19D3ClNO
Molecular Weight: 318.9
Chemical Structure
Doxepin-[d3] Hydrochloride
Description Doxepin-[d3] Hydrochloride is a labelled analogue of Doxepin. Doxepin is a tricyclic antidepressant (TCA) used for the treatment of major depression and anxiety.
Synonyms Doxepin HCl D3; 11-(3-Dimethylaminopropylidene-d3)-6,11-dihydrodibenz[b,e]oxepin Hydrochloride
IUPAC Name 3-(6H-benzo[c][1]benzoxepin-11-ylidene)-N-methyl-N-(trideuteriomethyl)propan-1-amine;hydrochloride
Related CAS 1229-29-4 (unlabelled)
Isomeric SMILES [2H]C([2H])([2H])N(C)CC/C=C\1/C2=CC=CC=C2COC3=CC=CC=C31.Cl
Canonical SMILES CN(C)CCC=C1C2=CC=CC=C2COC3=CC=CC=C31.Cl
InChI InChI=1S/C19H21NO.ClH/c1-20(2)13-7-11-17-16-9-4-3-8-15(16)14-21-19-12-6-5-10-18(17)19;/h3-6,8-12H,7,13-14H2,1-2H3;1H/i1D3;
InChI Key MHNSPTUQQIYJOT-NIIDSAIPSA-N
Melting Point 62-64°C
Purity 95% by CP; 98% atom D
Appearance Off-White to Yellow Solid

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