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Diethyl-(6-chloro1,2,3,4-tetrahydro-2-carbazolyl)methyl-[d3] Malonate

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General Information
Catalog: BLP-007762
CAS: 1189709-87-2
Molecular Formula: C20H21D3ClNO4
Molecular Weight: 380.88

Chemical Structure

Description	A labelled intermediate in the synthesis of Caprofen-d3.
Synonyms	(6-Chloro-2,3,4,9-tetrahydro-1H-carbazol-2-yl)methyl-propanedioic Acid Diethyl Ester-d3
IUPAC Name	diethyl 2-(6-chloro-2,3,4,9-tetrahydro-1H-carbazol-2-yl)-2-(trideuteriomethyl)propanedioate
Canonical SMILES	CCOC(=O)C(C)(C1CCC2=C(C1)NC3=C2C=C(C=C3)Cl)C(=O)OCC
InChI	InChI=1S/C20H24ClNO4/c1-4-25-18(23)20(3,19(24)26-5-2)12-6-8-14-15-11-13(21)7-9-16(15)22-17(14)10-12/h7,9,11-12,22H,4-6,8,10H2,1-3H3/i3D3
InChI Key	XWJZVIIPTMHYNQ-HPRDVNIFSA-N
Solubility	Soluble in Dichloromethane, Ethyl Acetate, Methanol
Appearance	Off-white Powder