Vitas-M small molecule compound
(E)-{1-[2-(dimethylammonio)ethyl]-2-(2-ethoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}(4-methoxy-2-methylphenyl)methanolate
Catalog ID
STK565189
SMILES CCOc1ccccc1C1N(CC[NH+](C)C)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 C25H30N2O5 MW 438.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30N2O5/c1-6-32-20-10-8-7-9-19(20)22-21(24(29)25(30)27(22)14-13-26(3)4)23(28)18-12-11-17(31-5)15-16(18)2/h7-12,15,22,28H,6,13-14H2,1-5H3/b23-21+InChIKey
RHROIRXDIZTISV-XTQSDGFTSA-NSynonyms
371202-44-7(4E)1(2DIMETHYLAMINOETHYL)5(2ETHOXYPHENYL)4(HYDROXY(4METHOXY2METHYLPHENYL)METHYLIDENE)PYRROLIDINE23DIONE
(E)(1(2(dimethylammonio)ethyl)2(2ethoxyphenyl)45dioxopyrrolidin3ylidene)(4methoxy2methylphenyl)methanolate
(E)(1(2(DIMETHYLAZANIUMYL)ETHYL)2(2ETHOXYPHENYL)45DIOXOPYRROLIDIN3YLIDENE)(4METHOXY2METHYLPHENYL)METHANOLATE
371202447
CCOC1=CC=CC=C1C2C(=C(C3=C(C=C(C=C3)OC)C)(O))C(=O)C(=O)N2CC(NH+)(C)C
CCOc1ccccc1C1N(CC(NH+)(C)C)C(=O)C(=O)C1=C(c1ccc(cc1C)OC)(O)
InChI=1SC25H30N2O5c1632201087919(20)2221(24(29)25(30)27(22)141326(3)4)23(28)18121117(315)1516(18)2h712152228H61314H215H3b2321+
MFCD18244711
ZINC000006197151
ZINC000102533191
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.