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

Catalog ID
STK566809
SMILES COc1cccc(c1)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)[N+](=O)[O-])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 C23H25N3O6 MW 439.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25N3O6/c1-24(2)11-6-12-25-20(15-7-4-9-17(13-15)26(30)31)19(22(28)23(25)29)21(27)16-8-5-10-18(14-16)32-3/h4-5,7-10,13-14,20,27H,6,11-12H2,1-3H3/b21-19+
InChIKey
IBAWAKUHKRWRDI-XUTLUUPISA-N
Synonyms
608497-93-4
(4E)1(3(DIMETHYLAMINO)PROPYL)4(HYDROXY(3METHOXYPHENYL)METHYLIDENE)5(3NITROPHENYL)PYRROLIDINE23DIONE
(4Z)1(3(DIMETHYLAMINO)PROPYL)4(HYDROXY(3METHOXYPHENYL)METHYLIDENE)5(3NITROPHENYL)PYRROLIDINE23DIONE
(E)(1(3(dimethylammonio)propyl)2(3nitrophenyl)45dioxopyrrolidin3ylidene)(3methoxyphenyl)methanolate
(E)(1(3(DIMETHYLAZANIUMYL)PROPYL)2(3NITROPHENYL)45DIOXOPYRROLIDIN3YLIDENE)(3METHOXYPHENYL)METHANOLATE
1(3(DIMETHYLAMINO)PROPYL)3HYDROXY4((3METHOXYPHENYL)CARBONYL)5(3NITROPHENYL)3PYRROLIN2ONE
608497934
C(NH+)(C)CCCN1C(C(=C(C2=CC(=CC=C2)OC)(O))C(=O)C1=O)C3=CC(=CC=C3)(N+)(=O)(O)
COc1cccc(c1)C(=C1C(=O)C(=O)N(C1c1cccc(c1)(N+)(=O)(O))CCC(NH+)(C)C)(O)
InChI=1SC23H25N3O6c124(2)116122520(1574917(1315)26(30)31)19(22(28)23(25)29)21(27)16851018(1416)323h4571013142027H61112H213H3b2119+
MFCD18245107
ZINC000009067315
ZINC000009240377

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Available files

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