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Cyclobenzaprine-[d3] Hydrochloride

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General Information
Catalog: BLP-012282
CAS: 1184983-42-3
Molecular Formula: C20H19D3ClN
Molecular Weight: 314.87

Chemical Structure

Description	Cyclobenzaprine-[d3] Hydrochloride is a labelled analogue of Cyclobenzaprine. Cyclobenzaprine is a medication used as a muscle relaxant.
Synonyms	Cyclobenzaprine D3 Hydrochloride
IUPAC Name	N-methyl-3-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaenylidene)-N-(trideuteriomethyl)propan-1-amine;hydrochloride
Related CAS	6202-23-9 (unlabelled) 1185192-83-9 (free base)
Isomeric SMILES	[2H]C([2H])([2H])N(C)CCC=C1C2=CC=CC=C2C=CC3=CC=CC=C31.Cl
Canonical SMILES	CN(C)CCC=C1C2=CC=CC=C2C=CC3=CC=CC=C31.Cl
InChI	InChI=1S/C20H21N.ClH/c1-21(2)15-7-12-20-18-10-5-3-8-16(18)13-14-17-9-4-6-11-19(17)20;/h3-6,8-14H,7,15H2,1-2H3;1H/i1D3;
InChI Key	VXEAYBOGHINOKW-NIIDSAIPSA-N
Melting Point	>210°C (dec.)
Purity	95% by HPLC; 95% atom D
Solubility	Soluble in Methanol, Water
Appearance	White to Pale Yellow Solid
Storage	Store at -20°C