Vitas-M small molecule compound
(4E)-4-[(4-chlorophenyl)(hydroxy)methylidene]-1-(3-hydroxypropyl)-5-(4-nitrophenyl)pyrrolidine-2,3-dione
Catalog ID
STL147862
SMILES OCCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)Cl)/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 C20H17ClN2O6 MW 416.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17ClN2O6/c21-14-6-2-13(3-7-14)18(25)16-17(12-4-8-15(9-5-12)23(28)29)22(10-1-11-24)20(27)19(16)26/h2-9,17,24-25H,1,10-11H2/b18-16+InChIKey
GDCMKOKZQXIVPW-FBMGVBCBSA-NSynonyms
425414-95-5(4E)4((4chlorophenyl)(hydroxy)methylidene)1(3hydroxypropyl)5(4nitrophenyl)pyrrolidine23dione
(4E)4((4CHLOROPHENYL)HYDROXYMETHYLIDENE)1(3HYDROXYPROPYL)5(4NITROPHENYL)PYRROLIDINE23DIONE
425414955
C1=CC(=CC=C1C2C(=C(C3=CC=C(C=C3)Cl)O)C(=O)C(=O)N2CCCO)(N+)(=O)(O)
InChI=1SC20H17ClN2O6c21146213(3714)18(25)1617(124815(9512)23(28)29)22(1011124)20(27)19(16)26h29172425H11011H2b1816+
MFCD03795842
OCCCN1C(=O)C(=O)C(=C(c2ccc(cc2)Cl)O)C1c1ccc(cc1)(N+)(=O)(O)
ZINC000102926758
ZINC000102926760
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