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Triazolomethylindole-3-acetic Acid-[d5]

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General Information
Catalog: BLP-007508
CAS: 1216889-22-3
Molecular Formula: C13H7D5N4O2
Molecular Weight: 261.29

Chemical Structure

Description	Triazolomethylindole-3-acetic Acid-[d5] is a labelled metabolite of Rizatriptan.
Synonyms	5-(1H-1,2,4-Triazol-1-ylmethyl)-1H-indole-3-acetic Acid-d5
IUPAC Name	2-[4,6,7-trideuterio-5-[dideuterio(1,2,4-triazol-1-yl)methyl]-1H-indol-3-yl]acetic acid
Related CAS	177270-91-6 (unlabelled)
Canonical SMILES	C1=CC2=C(C=C1CN3C=NC=N3)C(=CN2)CC(=O)O
InChI	InChI=1S/C13H12N4O2/c18-13(19)4-10-5-15-12-2-1-9(3-11(10)12)6-17-8-14-7-16-17/h1-3,5,7-8,15H,4,6H2,(H,18,19)/i1D,2D,3D,6D2
InChI Key	KACIHDPNKNLLMA-JZOBIDBQSA-N