Vitas-M small molecule compound
4-methyl-3-(3-methylbutyl)-7-[(4-nitrobenzyl)oxy]-2H-chromen-2-one
Catalog ID
STL513209
SMILES CC(CCc1c(=O)oc2c(c1C)ccc(c2)OCc1ccc(cc1)[N+](=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 C22H23NO5 MW 381.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23NO5/c1-14(2)4-10-20-15(3)19-11-9-18(12-21(19)28-22(20)24)27-13-16-5-7-17(8-6-16)23(25)26/h5-9,11-12,14H,4,10,13H2,1-3H3InChIKey
QLICOMSZVSPJDG-UHFFFAOYSA-NSynonyms
376380-48-21424820
376380482
3ISOPENTYL4METHYL7((4NITROBENZYL)OXY)2HCHROMEN2ONE
4methyl3(3methylbutyl)7((4nitrobenzyl)oxy)2Hchromen2one
4METHYL3(3METHYLBUTYL)7((4NITROPHENYL)METHOXY)CHROMEN2ONE
CC(CCc1c(=O)oc2c(c1C)ccc(c2)OCc1ccc(cc1)(N+)(=O)(O))C
InChI=1SC22H23NO5c114(2)4102015(3)1911918(1221(19)2822(20)24)2713165717(8616)23(25)26h59111214H41013H213H3
MFCD02925535
ZINC000004028946
ZINC4028946
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