Vitas-M small molecule compound
2-(4,5-dimethyl-3-oxido-1H-imidazol-1-yl)-3-phenylpropanoic acid
Catalog ID
STK623508
SMILES OC(=O)C(n1c[n+](c(c1C)C)[O-])Cc1ccccc1
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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 C14H16N2O3 MW 260.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H16N2O3/c1-10-11(2)16(19)9-15(10)13(14(17)18)8-12-6-4-3-5-7-12/h3-7,9,13H,8H2,1-2H3,(H,17,18)InChIKey
HHLHQCWJVHHZLC-UHFFFAOYSA-NSynonyms
126263-21-61(1CARBOXY2PHENYLETHYL)45DIMETHYL1HIMIDAZOLE3OXIDE
126263216
2(45dimethyl3oxido1Himidazol1yl)3phenylpropanoicacid
2(45dimethyl3oxidoimidazol3ium1yl)3phenylpropanoicacid
CC1=C((N+)(=CN1C(CC2=CC=CC=C2)C(=O)O)(O))C
InChI=1SC14H16N2O3c11011(2)16(19)915(10)13(14(17)18)8126435712h37913H8H212H3(H1718)
MFCD09749787
OC(=O)C(n1c(n+)(c(c1C)C)(O))Cc1ccccc1
ZINC000009576774
ZINC000009576775
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