Vitas-M small molecule compound
5-{[5-(2-chloro-5-nitrophenyl)furan-2-yl]methylidene}-2,2-dimethyl-1,3-dioxane-4,6-dione
Catalog ID
STL477247
SMILES O=C1OC(C)(C)OC(=O)C1=Cc1ccc(o1)c1cc(ccc1Cl)[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 C17H12ClNO7 MW 377.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12ClNO7/c1-17(2)25-15(20)12(16(21)26-17)8-10-4-6-14(24-10)11-7-9(19(22)23)3-5-13(11)18/h3-8H,1-2H3InChIKey
GRKHDVDWRMRUFT-UHFFFAOYSA-NSynonyms
(13)DIOXANE46DIONE5(5(2CHLORO5NITROPHENYL)FURAN2YLMETHYLENE)22DIMETHYL
5((5(2CHLORO5NITROPHENYL)(2FURYL))METHYLENE)22DIMETHYL13DIOXANE46DIONE
5((5(2CHLORO5NITROPHENYL)2FURYL)METHYLENE)22DIMETHYL13DIOXANE46DIONE
5((5(2chloro5nitrophenyl)furan2yl)methylidene)22dimethyl13dioxane46dione
CC1(OC(=O)C(=CC2=CC=C(O2)C3=C(C=CC(=C3)(N+)(=O)(O))Cl)C(=O)O1)C
InChI=1SC17H12ClNO7c117(2)2515(20)12(16(21)2617)8104614(2410)1179(19(22)23)3513(11)18h38H12H3
MFCD01095970
O=C1OC(C)(C)OC(=O)C1=Cc1ccc(o1)c1cc(ccc1Cl)(N+)(=O)(O)
ZINC000005415332
ZINC05415332
ZINC5415332
Check stock
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