Vitas-M small molecule compound
(4E)-5-(2-chlorophenyl)-1-[2-(2-hydroxyethoxy)ethyl]-4-[hydroxy(3-nitrophenyl)methylidene]pyrrolidine-2,3-dione
Catalog ID
STK595366
SMILES OCCOCCN1C(=O)C(=O)/C(=C(\c2cccc(c2)[N+](=O)[O-])/O)/C1c1ccccc1Cl
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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 C21H19ClN2O7 MW 446.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19ClN2O7/c22-16-7-2-1-6-15(16)18-17(19(26)13-4-3-5-14(12-13)24(29)30)20(27)21(28)23(18)8-10-31-11-9-25/h1-7,12,18,25-26H,8-11H2/b19-17+InChIKey
HKWKGZJVFBQBGS-HTXNQAPBSA-NSynonyms
517890-25-4(4E)5(2chlorophenyl)1(2(2hydroxyethoxy)ethyl)4(hydroxy(3nitrophenyl)methylidene)pyrrolidine23dione
517890254
C1=CC=C(C(=C1)C2C(=C(C3=CC(=CC=C3)(N+)(=O)(O))O)C(=O)C(=O)N2CCOCCO)Cl
InChI=1SC21H19ClN2O7c2216721615(16)1817(19(26)1343514(1213)24(29)30)20(27)21(28)23(18)8103111925h1712182526H811H2b1917+
MFCD07211640
OCCOCCN1C(=O)C(=O)C(=C(c2cccc(c2)(N+)(=O)(O))O)C1c1ccccc1Cl
ZINC000102617711
ZINC000102617720
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