Vitas-M small molecule compound
(4E)-1-[2-(2-hydroxyethoxy)ethyl]-4-[hydroxy(3-nitrophenyl)methylidene]-5-(4-methoxyphenyl)pyrrolidine-2,3-dione
Catalog ID
STL049840
SMILES OCCOCCN1C(=O)C(=O)/C(=C(\c2cccc(c2)[N+](=O)[O-])/O)/C1c1ccc(cc1)OC
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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 C22H22N2O8 MW 442.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N2O8/c1-31-17-7-5-14(6-8-17)19-18(20(26)15-3-2-4-16(13-15)24(29)30)21(27)22(28)23(19)9-11-32-12-10-25/h2-8,13,19,25-26H,9-12H2,1H3/b20-18+InChIKey
BQDMFRTUBXPGJS-CZIZESTLSA-NSynonyms
517890-21-0(4E)1(2(2hydroxyethoxy)ethyl)4(hydroxy(3nitrophenyl)methylidene)5(4methoxyphenyl)pyrrolidine23dione
517890210
COC1=CC=C(C=C1)C2C(=C(C3=CC(=CC=C3)(N+)(=O)(O))O)C(=O)C(=O)N2CCOCCO
InChI=1SC22H22N2O8c131177514(6817)1918(20(26)1532416(1315)24(29)30)21(27)22(28)23(19)91132121025h2813192526H912H21H3b2018+
MFCD05730020
OCCOCCN1C(=O)C(=O)C(=C(c2cccc(c2)(N+)(=O)(O))O)C1c1ccc(cc1)OC
ZINC000102886012
ZINC000102886015
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