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

Catalog ID
STK563679
SMILES C=CCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)OC(C)C)CC[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 C27H32N2O5 MW 464.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H32N2O5/c1-6-17-33-21-11-9-20(10-12-21)25(30)23-24(19-7-13-22(14-8-19)34-18(2)3)29(16-15-28(4)5)27(32)26(23)31/h6-14,18,24,30H,1,15-17H2,2-5H3/b25-23+
InChIKey
RSTUQPWIOIPVKN-WJTDDFOZSA-N
Synonyms
847185-36-8
(4E)1(2DIMETHYLAMINOETHYL)4(HYDROXY(4PROP2ENOXYPHENYL)METHYLIDENE)5(4PROPAN2YLOXYPHENYL)PYRROLIDINE23DIONE
(E)(1(2(dimethylammonio)ethyl)45dioxo2(4(propan2yloxy)phenyl)pyrrolidin3ylidene)(4(prop2en1yloxy)phenyl)methanolate
(E)(1(2(DIMETHYLAZANIUMYL)ETHYL)45DIOXO2(4PROPAN2YLOXYPHENYL)PYRROLIDIN3YLIDENE)(4PROP2ENOXYPHENYL)METHANOLATE
1(2(DIMETHYLAMINO)ETHYL)3HYDROXY5(4(METHYLETHOXY)PHENYL)4((4PROP2ENYLOXYPHENYL)CARBONYL)3PYRROLIN2ONE
847185368
C=CCOc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1ccc(cc1)OC(C)C)CC(NH+)(C)C)(O)
CC(C)OC1=CC=C(C=C1)C2C(=C(C3=CC=C(C=C3)OCC=C)(O))C(=O)C(=O)N2CC(NH+)(C)C
InChI=1SC27H32N2O5c1617332111920(101221)25(30)2324(1971322(14819)3418(2)3)29(161528(4)5)27(32)26(23)31h614182430H11517H225H3b2523+
MFCD18244354
ZINC000101287574
ZINC000101287576

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Available files

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