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(E)-{2-(3,4-dichlorophenyl)-1-[2-(diethylammonio)ethyl]-4,5-dioxopyrrolidin-3-ylidene}[2-methyl-4-(2-methylpropoxy)phenyl]methanolate

Catalog ID
STL046672
SMILES CC[NH+](CCN1C(c2ccc(c(c2)Cl)Cl)/C(=C(/c2ccc(cc2C)OCC(C)C)\[O-])/C(=O)C1=O)CC

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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 C28H34Cl2N2O4 MW 533.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H34Cl2N2O4/c1-6-31(7-2)12-13-32-25(19-8-11-22(29)23(30)15-19)24(27(34)28(32)35)26(33)21-10-9-20(14-18(21)5)36-16-17(3)4/h8-11,14-15,17,25,33H,6-7,12-13,16H2,1-5H3/b26-24+
InChIKey
IDDWEIBADOMXLZ-SHHOIMCASA-N
Synonyms
489413-75-4
(4E)5(34dichlorophenyl)1(2(diethylamino)ethyl)4(hydroxy(2methyl4(2methylpropoxy)phenyl)methylidene)pyrrolidine23dione
(4E)5(34DICHLOROPHENYL)1(2DIETHYLAMINOETHYL)4(HYDROXY(2METHYL4(2METHYLPROPOXY)PHENYL)METHYLIDENE)PYRROLIDINE23DIONE
(E)(2(34dichlorophenyl)1(2(diethylammonio)ethyl)45dioxopyrrolidin3ylidene)(2methyl4(2methylpropoxy)phenyl)methanolate
(E)(2(34DICHLOROPHENYL)1(2(DIETHYLAZANIUMYL)ETHYL)45DIOXOPYRROLIDIN3YLIDENE)(2METHYL4(2METHYLPROPOXY)PHENYL)METHANOLATE
489413754
CC(NH+)(CCN1C(c2ccc(c(c2)Cl)Cl)C(=C(c2ccc(cc2C)OCC(C)C)(O))C(=O)C1=O)CC
CCN(CC)CCN1C(C(=C(C2=C(C=C(C=C2)OCC(C)C)C)O)C(=O)C1=O)C3=CC(=C(C=C3)Cl)Cl
InChI=1SC28H34Cl2N2O4c1631(72)12133225(1981122(29)23(30)1519)24(27(34)28(32)35)26(33)2110920(1418(21)5)361617(3)4h8111415172533H67121316H215H3b2624+
MFCD18248905
ZINC000102880443
ZINC000102880444

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Available files

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