Vitas-M small molecule compound
4-acetyl-3-benzyl-1-phenyl-1H-1,2,3-triazol-3-ium-5-olate
Catalog ID
STL448390
SMILES CC(=O)c1[n+](Cc2ccccc2)nn(c1[O-])c1ccccc1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C17H15N3O2 MW 293.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15N3O2/c1-13(21)16-17(22)20(15-10-6-3-7-11-15)18-19(16)12-14-8-4-2-5-9-14/h2-11H,12H2,1H3InChIKey
LFRKRGXIYKFJRJ-UHFFFAOYSA-NSynonyms
4acetyl3benzyl1phenyl1H123triazol3ium5olate
5ACETYL1BENZYL3PHENYLTRIAZOL1IUM4OLATE
CC(=O)c1(n+)(Cc2ccccc2)nn(c1(O))c1ccccc1
CC(=O)C1=C(N(N=(N+)1CC2=CC=CC=C2)C3=CC=CC=C3)(O)
InChI=1SC17H15N3O2c113(21)1617(22)20(15106371115)1819(16)12148425914h211H12H21H3
MFCD07773843
ZINC000005274780
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