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(E)-{1-[3-(dimethylammonio)propyl]-2-(4-fluorophenyl)-4,5-dioxopyrrolidin-3-ylidene}(3-methoxyphenyl)methanolate

Catalog ID
STK563029
SMILES COc1cccc(c1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)F)CCC[NH+](C)C)/[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 C23H25FN2O4 MW 412.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25FN2O4/c1-25(2)12-5-13-26-20(15-8-10-17(24)11-9-15)19(22(28)23(26)29)21(27)16-6-4-7-18(14-16)30-3/h4,6-11,14,20,27H,5,12-13H2,1-3H3/b21-19+
InChIKey
BFAQWHMALXTPMD-XUTLUUPISA-N
Synonyms
608497-96-7
(4E)1(3(DIMETHYLAMINO)PROPYL)5(4FLUOROPHENYL)4(HYDROXY(3METHOXYPHENYL)METHYLIDENE)PYRROLIDINE23DIONE
(4Z)1(3(DIMETHYLAMINO)PROPYL)5(4FLUOROPHENYL)4(HYDROXY(3METHOXYPHENYL)METHYLIDENE)PYRROLIDINE23DIONE
(E)(1(3(dimethylammonio)propyl)2(4fluorophenyl)45dioxopyrrolidin3ylidene)(3methoxyphenyl)methanolate
(E)(1(3(DIMETHYLAZANIUMYL)PROPYL)2(4FLUOROPHENYL)45DIOXOPYRROLIDIN3YLIDENE)(3METHOXYPHENYL)METHANOLATE
1(3(DIMETHYLAMINO)PROPYL)5(4FLUOROPHENYL)3HYDROXY4((3METHOXYPHENYL)CARBONYL)3PYRROLIN2ONE
608497967
C(NH+)(C)CCCN1C(C(=C(C2=CC(=CC=C2)OC)(O))C(=O)C1=O)C3=CC=C(C=C3)F
COc1cccc(c1)C(=C1C(=O)C(=O)N(C1c1ccc(cc1)F)CCC(NH+)(C)C)(O)
InChI=1SC23H25FN2O4c125(2)125132620(1581017(24)11915)19(22(28)23(26)29)21(27)1664718(1416)303h4611142027H51213H213H3b2119+
MFCD18244194
ZINC000005799810
ZINC000005799835

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Available files

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