Vitas-M small molecule compound

(E)-{1-[2-(diethylammonio)ethyl]-2-(2-ethoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}(4-methoxy-2-methylphenyl)methanolate

Catalog ID
STL040209
SMILES CCOc1ccccc1C1N(CC[NH+](CC)CC)C(=O)C(=O)/C/1=C(\c1ccc(cc1C)OC)/[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 C27H34N2O5 MW 466.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H34N2O5/c1-6-28(7-2)15-16-29-24(21-11-9-10-12-22(21)34-8-3)23(26(31)27(29)32)25(30)20-14-13-19(33-5)17-18(20)4/h9-14,17,24,30H,6-8,15-16H2,1-5H3/b25-23+
InChIKey
FLMHOVRUKJTQLP-WJTDDFOZSA-N
Synonyms
487026-41-5
(4E)1(2(diethylamino)ethyl)5(2ethoxyphenyl)4(hydroxy(4methoxy2methylphenyl)methylidene)pyrrolidine23dione
(4E)1(2DIETHYLAMINOETHYL)5(2ETHOXYPHENYL)4(HYDROXY(4METHOXY2METHYLPHENYL)METHYLIDENE)PYRROLIDINE23DIONE
(E)(1(2(diethylammonio)ethyl)2(2ethoxyphenyl)45dioxopyrrolidin3ylidene)(4methoxy2methylphenyl)methanolate
(E)(1(2(DIETHYLAZANIUMYL)ETHYL)2(2ETHOXYPHENYL)45DIOXOPYRROLIDIN3YLIDENE)(4METHOXY2METHYLPHENYL)METHANOLATE
487026415
CCN(CC)CCN1C(C(=C(C2=C(C=C(C=C2)OC)C)O)C(=O)C1=O)C3=CC=CC=C3OCC
CCOc1ccccc1C1N(CC(NH+)(CC)CC)C(=O)C(=O)C1=C(c1ccc(cc1C)OC)(O)
InChI=1SC27H34N2O5c1628(72)15162924(21119101222(21)3483)23(26(31)27(29)32)25(30)20141319(335)1718(20)4h914172430H681516H215H3b2523+
MFCD18247979
ZINC000102866221
ZINC000102866223

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Available files

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