Vitas-M small molecule compound
(E)-{1-[2-(diethylammonio)ethyl]-2-(3-nitrophenyl)-4,5-dioxopyrrolidin-3-ylidene}(4-ethoxyphenyl)methanolate
Catalog ID
STL036943
SMILES CCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)[N+](=O)[O-])CC[NH+](CC)CC)/[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 C25H29N3O6 MW 467.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29N3O6/c1-4-26(5-2)14-15-27-22(18-8-7-9-19(16-18)28(32)33)21(24(30)25(27)31)23(29)17-10-12-20(13-11-17)34-6-3/h7-13,16,22,29H,4-6,14-15H2,1-3H3/b23-21+InChIKey
VBNVRLFZUOGHPO-XTQSDGFTSA-NSynonyms
615278-94-9(4E)1(2(diethylamino)ethyl)4((4ethoxyphenyl)hydroxymethylidene)5(3nitrophenyl)pyrrolidine23dione
(4E)1(2DIETHYLAMINOETHYL)4((4ETHOXYPHENYL)HYDROXYMETHYLIDENE)5(3NITROPHENYL)PYRROLIDINE23DIONE
(E)(1(2(diethylammonio)ethyl)2(3nitrophenyl)45dioxopyrrolidin3ylidene)(4ethoxyphenyl)methanolate
(E)(1(2(DIETHYLAZANIUMYL)ETHYL)2(3NITROPHENYL)45DIOXOPYRROLIDIN3YLIDENE)(4ETHOXYPHENYL)METHANOLATE
1(2(DIETHYLAMINO)ETHYL)4((4ETHOXYPHENYL)CARBONYL)3HYDROXY5(3NITROPHENYL)3PYRROLIN2ONE
615278949
CCN(CC)CCN1C(C(=C(C2=CC=C(C=C2)OCC)O)C(=O)C1=O)C3=CC(=CC=C3)(N+)(=O)(O)
CCOc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1cccc(c1)(N+)(=O)(O))CC(NH+)(CC)CC)(O)
InChI=1SC25H29N3O6c1426(52)14152722(1887919(1618)28(32)33)21(24(30)25(27)31)23(29)17101220(131117)3463h713162229H461415H213H3b2321+
MFCD18247328
ZINC000009070876
ZINC000009070879
Check stock
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Check stock on Vitas-MAvailable files
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