Vitas-M small molecule compound
(2Z)-2-(3-nitrobenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl methanesulfonate
Catalog ID
STK923642
SMILES O=C1/C(=C/c2cccc(c2)[N+](=O)[O-])/Oc2c1ccc(c2)OS(=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 C16H11NO7S MW 361.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11NO7S/c1-25(21,22)24-12-5-6-13-14(9-12)23-15(16(13)18)8-10-3-2-4-11(7-10)17(19)20/h2-9H,1H3/b15-8-InChIKey
GEEQEOWXWMHDQU-NVNXTCNLSA-NSynonyms
674813-89-9((2Z)2((3NITROPHENYL)METHYLIDENE)3OXO1BENZOFURAN6YL)METHANESULFONATE
(2Z)2(3nitrobenzylidene)3oxo23dihydro1benzofuran6ylmethanesulfonate
(Z)2(3nitrobenzylidene)3oxo23dihydrobenzofuran6ylmethanesulfonate
2((3NITROPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YLMETHYLSULFONATE
674813899
CS(=O)(=O)OC1=CC2=C(C=C1)C(=O)C(=CC3=CC(=CC=C3)(N+)(=O)(O))O2
InChI=1SC16H11NO7Sc125(2122)2412561314(912)2315(16(13)18)81032411(710)17(19)20h29H1H3b158
MFCD04077308
O=C1C(=Cc2cccc(c2)(N+)(=O)(O))Oc2c1ccc(c2)OS(=O)(=O)C
ZINC000005219738
ZINC05219738
ZINC5219738
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