Vitas-M small molecule compound

3-methyl-2-(3-oxido-4,5-diphenyl-1H-imidazol-1-yl)pentanoic acid

Catalog ID
STK991414
SMILES CCC(C(n1c[n+](c(c1c1ccccc1)c1ccccc1)[O-])C(=O)O)C

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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 C21H22N2O3 MW 350.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O3/c1-3-15(2)18(21(24)25)22-14-23(26)20(17-12-8-5-9-13-17)19(22)16-10-6-4-7-11-16/h4-15,18H,3H2,1-2H3,(H,24,25)
InChIKey
UAJTZFAZHIEZAX-UHFFFAOYSA-N
Synonyms
881567-60-8
3methyl2(3oxido45diphenyl1Himidazol1yl)pentanoicacid
3methyl2(3oxido45diphenylimidazol3ium1yl)pentanoicacid
881567608
CCC(C(n1c(n+)(c(c1c1ccccc1)c1ccccc1)(O))C(=O)O)C
CCC(C)C(C(=O)O)N1C=(N+)(C(=C1C2=CC=CC=C2)C3=CC=CC=C3)(O)
InChI=1SC21H22N2O3c1315(2)18(21(24)25)221423(26)20(17128591317)19(22)16106471116h41518H3H212H3(H2425)
MFCD07801945
ZINC000005031240
ZINC000005031256

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.