Vitas-M small molecule compound

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

Catalog ID
STK580691
SMILES CCCCN1C(c2cccc(c2)[N+](=O)[O-])/C(=C(/c2ccc(cc2)[N+](=O)[O-])\O)/C(=O)C1=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 C21H19N3O7 MW 425.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N3O7/c1-2-3-11-22-18(14-5-4-6-16(12-14)24(30)31)17(20(26)21(22)27)19(25)13-7-9-15(10-8-13)23(28)29/h4-10,12,18,25H,2-3,11H2,1H3/b19-17+
InChIKey
UCOOIRUBDYPYSI-HTXNQAPBSA-N
Synonyms
497868-13-0
(4E)1butyl4(hydroxy(4nitrophenyl)methylidene)5(3nitrophenyl)pyrrolidine23dione
497868130
CCCCN1C(C(=C(C2=CC=C(C=C2)(N+)(=O)(O))O)C(=O)C1=O)C3=CC(=CC=C3)(N+)(=O)(O)
CCCCN1C(c2cccc(c2)(N+)(=O)(O))C(=C(c2ccc(cc2)(N+)(=O)(O))O)C(=O)C1=O
InChI=1SC21H19N3O7c123112218(1454616(1214)24(30)31)17(20(26)21(22)27)19(25)137915(10813)23(28)29h410121825H2311H21H3b1917+
MFCD07205673
ZINC000102588925
ZINC000102588930

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Available files

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