Vitas-M small molecule compound

(4E)-1-[2-(2-hydroxyethoxy)ethyl]-4-[hydroxy(3-nitrophenyl)methylidene]-5-(4-methylphenyl)pyrrolidine-2,3-dione

Catalog ID
STL053207
SMILES OCCOCCN1C(=O)C(=O)/C(=C(\c2cccc(c2)[N+](=O)[O-])/O)/C1c1ccc(cc1)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 C22H22N2O7 MW 426.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N2O7/c1-14-5-7-15(8-6-14)19-18(20(26)16-3-2-4-17(13-16)24(29)30)21(27)22(28)23(19)9-11-31-12-10-25/h2-8,13,19,25-26H,9-12H2,1H3/b20-18+
InChIKey
UOKOTSHUAYUGHY-CZIZESTLSA-N
Synonyms
517890-20-9
(4E)1(2(2hydroxyethoxy)ethyl)4(hydroxy(3nitrophenyl)methylidene)5(4methylphenyl)pyrrolidine23dione
517890209
CC1=CC=C(C=C1)C2C(=C(C3=CC(=CC=C3)(N+)(=O)(O))O)C(=O)C(=O)N2CCOCCO
InChI=1SC22H22N2O7c1145715(8614)1918(20(26)1632417(1316)24(29)30)21(27)22(28)23(19)91131121025h2813192526H912H21H3b2018+
MFCD05729731
OCCOCCN1C(=O)C(=O)C(=C(c2cccc(c2)(N+)(=O)(O))O)C1c1ccc(cc1)C
ZINC000102890938
ZINC000102890939

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Available files

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