Vitas-M small molecule compound
(4E)-1-butyl-4-[hydroxy(4-nitrophenyl)methylidene]-5-(4-nitrophenyl)pyrrolidine-2,3-dione
Catalog ID
STK597823
SMILES CCCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)[N+](=O)[O-])/O)/C1c1ccc(cc1)[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 C21H19N3O7 MW 425.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N3O7/c1-2-3-12-22-18(13-4-8-15(9-5-13)23(28)29)17(20(26)21(22)27)19(25)14-6-10-16(11-7-14)24(30)31/h4-11,18,25H,2-3,12H2,1H3/b19-17+InChIKey
OEZQDNVQZAFVNF-HTXNQAPBSA-NSynonyms
500276-26-6(4E)1butyl4(hydroxy(4nitrophenyl)methylidene)5(4nitrophenyl)pyrrolidine23dione
500276266
CCCCN1C(=O)C(=O)C(=C(c2ccc(cc2)(N+)(=O)(O))O)C1c1ccc(cc1)(N+)(=O)(O)
CCCCN1C(C(=C(C2=CC=C(C=C2)(N+)(=O)(O))O)C(=O)C1=O)C3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC21H19N3O7c123122218(134815(9513)23(28)29)17(20(26)21(22)27)19(25)1461016(11714)24(30)31h4111825H2312H21H3b1917+
MFCD07212241
ZINC000102623813
ZINC000102623818
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