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(R)-Citalopram Oxalate-[d6]

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General Information
Catalog: BLP-000484
CAS: 1217768-91-6
Molecular Formula: C22H17D6FN2O5
Molecular Weight: 420.46

Chemical Structure

Description	(R)-Citalopram Oxalate-[d6], is the labelled analogue of (R)-Citalopram Oxalate. (R)-Citalopram Oxalate is an inhibitor of serotonin (5-HT) uptake. It shows antidepressant activity.
Synonyms	1-[3-(Dimethylamino-d6)propyl]-1-(4-fluoro-phenyl)-1,3-dihydro-isobenzofuran-5-carbonitrile Oxalate; (R)-Citalopram-d6 Oxalate
IUPAC Name	(1R)-1-[3-[bis(trideuteriomethyl)amino]propyl]-1-(4-fluorophenyl)-3H-2-benzofuran-5-carbonitrile;oxalic acid
Related CAS	219861-53-7 (unlabelled)
Canonical SMILES	CN(C)CCCC1(C2=C(CO1)C=C(C=C2)C#N)C3=CC=C(C=C3)F.C(=O)(C(=O)O)O
InChI	InChI=1S/C20H21FN2O.C2H2O4/c1-23(2)11-3-10-20(17-5-7-18(21)8-6-17)19-9-4-15(13-22)12-16(19)14-24-20;3-1(4)2(5)6/h4-9,12H,3,10-11,14H2,1-2H3;(H,3,4)(H,5,6)/t20-;/m1./s1/i1D3,2D3;
InChI Key	KTGRHKOEFSJQNS-GIJPFRRLSA-N
Melting Point	153-155°C
Appearance	White Solid