Vitas-M small molecule compound
2,2-dimethyl-5-{[5-(2-methyl-5-nitrophenyl)furan-2-yl]methylidene}-1,3-dioxane-4,6-dione
Catalog ID
STK756182
SMILES O=C1OC(C)(C)OC(=O)C1=Cc1ccc(o1)c1cc(ccc1C)[N+](=O)[O-]
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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 C18H15NO7 MW 357.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15NO7/c1-10-4-5-11(19(22)23)8-13(10)15-7-6-12(24-15)9-14-16(20)25-18(2,3)26-17(14)21/h4-9H,1-3H3InChIKey
QHGYBWFVFTZROJ-UHFFFAOYSA-NSynonyms
22dimethyl5((5(2methyl5nitrophenyl)furan2yl)methylidene)13dioxane46dione
CC1=C(C=C(C=C1)(N+)(=O)(O))C2=CC=C(O2)C=C3C(=O)OC(OC3=O)(C)C
InChI=1SC18H15NO7c1104511(19(22)23)813(10)157612(2415)91416(20)2518(23)2617(14)21h49H13H3
MFCD01061811
O=C1OC(C)(C)OC(=O)C1=Cc1ccc(o1)c1cc(ccc1C)(N+)(=O)(O)
ZINC000000861917
ZINC00861917
ZINC861917
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