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(E)-{1-[3-(dimethylammonio)propyl]-4,5-dioxo-2-[3-(prop-2-en-1-yloxy)phenyl]pyrrolidin-3-ylidene}(4-fluorophenyl)methanolate

Catalog ID
STK563365
SMILES C=CCOc1cccc(c1)C1/C(=C(/c2ccc(cc2)F)\[O-])/C(=O)C(=O)N1CCC[NH+](C)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 C25H27FN2O4 MW 438.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27FN2O4/c1-4-15-32-20-8-5-7-18(16-20)22-21(23(29)17-9-11-19(26)12-10-17)24(30)25(31)28(22)14-6-13-27(2)3/h4-5,7-12,16,22,29H,1,6,13-15H2,2-3H3/b23-21+
InChIKey
FYBIKRFOIDAECY-XTQSDGFTSA-N
Synonyms
620143-26-2
(4E)1(3(DIMETHYLAMINO)PROPYL)4((4FLUOROPHENYL)HYDROXYMETHYLIDENE)5(3PROP2ENOXYPHENYL)PYRROLIDINE23DIONE
(4Z)1(3(DIMETHYLAMINO)PROPYL)4((4FLUOROPHENYL)HYDROXYMETHYLIDENE)5(3PROP2ENOXYPHENYL)PYRROLIDINE23DIONE
(E)(1(3(dimethylammonio)propyl)45dioxo2(3(prop2en1yloxy)phenyl)pyrrolidin3ylidene)(4fluorophenyl)methanolate
(E)(1(3(DIMETHYLAZANIUMYL)PROPYL)45DIOXO2(3PROP2ENOXYPHENYL)PYRROLIDIN3YLIDENE)(4FLUOROPHENYL)METHANOLATE
1(3(DIMETHYLAMINO)PROPYL)4((4FLUOROPHENYL)CARBONYL)3HYDROXY5(3PROP2ENYLOXYPHENYL)3PYRROLIN2ONE
620143262
C=CCOc1cccc(c1)C1C(=C(c2ccc(cc2)F)(O))C(=O)C(=O)N1CCC(NH+)(C)C
CN(C)CCCN1C(C(=C(C2=CC=C(C=C2)F)O)C(=O)C1=O)C3=CC(=CC=C3)OCC=C
InChI=1SC25H27FN2O4c1415322085718(1620)2221(23(29)1791119(26)121017)24(30)25(31)28(22)1461327(2)3h45712162229H161315H223H3b2321+
MFCD18244277
ZINC000101313379
ZINC000101313383

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Available files

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