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

Catalog ID
STK561643
SMILES COc1cccc(c1OC)C1/C(=C(/c2ccc(c(c2)Cl)OC)\[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 C25H29ClN2O6 MW 488.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29ClN2O6/c1-27(2)12-7-13-28-21(16-8-6-9-19(33-4)24(16)34-5)20(23(30)25(28)31)22(29)15-10-11-18(32-3)17(26)14-15/h6,8-11,14,21,29H,7,12-13H2,1-5H3/b22-20+
InChIKey
NMUIOTJMVSQNLZ-LSDHQDQOSA-N
Synonyms
636987-35-4
(4E)4((3CHLORO4METHOXYPHENYL)HYDROXYMETHYLIDENE)5(23DIMETHOXYPHENYL)1(3(DIMETHYLAMINO)PROPYL)PYRROLIDINE23DIONE
(4Z)4((3CHLORO4METHOXYPHENYL)HYDROXYMETHYLIDENE)5(23DIMETHOXYPHENYL)1(3(DIMETHYLAMINO)PROPYL)PYRROLIDINE23DIONE
(E)(3chloro4methoxyphenyl)(2(23dimethoxyphenyl)1(3(dimethylammonio)propyl)45dioxopyrrolidin3ylidene)methanolate
(E)(3CHLORO4METHOXYPHENYL)(2(23DIMETHOXYPHENYL)1(3(DIMETHYLAZANIUMYL)PROPYL)45DIOXOPYRROLIDIN3YLIDENE)METHANOLATE
5(23DIMETHOXYPHENYL)1(3(DIMETHYLAMINO)PROPYL)4((3CHLORO4METHOXYPHENYL)CARBONYL)3HYDROXY3PYRROLIN2ONE
636987354
C(NH+)(C)CCCN1C(C(=C(C2=CC(=C(C=C2)OC)Cl)(O))C(=O)C1=O)C3=C(C(=CC=C3)OC)OC
COc1cccc(c1OC)C1C(=C(c2ccc(c(c2)Cl)OC)(O))C(=O)C(=O)N1CCC(NH+)(C)C
InChI=1SC25H29ClN2O6c127(2)127132821(1686919(334)24(16)345)20(23(30)25(28)31)22(29)15101118(323)17(26)1415h6811142129H71213H215H3b2220+
MFCD18243850
ZINC000008920161
ZINC000008920165

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Available files

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