Vitas-M small molecule compound
(4E)-1-(2-hydroxyethyl)-4-[hydroxy(4-methoxyphenyl)methylidene]-5-(2-nitrophenyl)pyrrolidine-2,3-dione
Catalog ID
STL148157
SMILES OCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)OC)/O)/C1c1ccccc1[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 C20H18N2O7 MW 398.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N2O7/c1-29-13-8-6-12(7-9-13)18(24)16-17(21(10-11-23)20(26)19(16)25)14-4-2-3-5-15(14)22(27)28/h2-9,17,23-24H,10-11H2,1H3/b18-16+InChIKey
HUJHPEXSGQKHKE-FBMGVBCBSA-NSynonyms
(4E)1(2hydroxyethyl)4(hydroxy(4methoxyphenyl)methylidene)5(2nitrophenyl)pyrrolidine23dione
COC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CCO)C3=CC=CC=C3(N+)(=O)(O))O
InChI=1SC20H18N2O7c129138612(7913)18(24)1617(21(101123)20(26)19(16)25)14423515(14)22(27)28h29172324H1011H21H3b1816+
MFCD03795428
OCCN1C(=O)C(=O)C(=C(c2ccc(cc2)OC)O)C1c1ccccc1(N+)(=O)(O)
ZINC000102925888
ZINC000102925892
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