Vitas-M small molecule compound
(E)-{1-[2-(dimethylammonio)ethyl]-2-(3-nitrophenyl)-4,5-dioxopyrrolidin-3-ylidene}(4-methylphenyl)methanolate
Catalog ID
STL147519
SMILES Cc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)[N+](=O)[O-])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 C22H23N3O5 MW 409.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N3O5/c1-14-7-9-15(10-8-14)20(26)18-19(16-5-4-6-17(13-16)25(29)30)24(12-11-23(2)3)22(28)21(18)27/h4-10,13,19,26H,11-12H2,1-3H3/b20-18+InChIKey
MFZCDHIHSSWHCT-CZIZESTLSA-NSynonyms
432011-24-0(4E)1(2(dimethylamino)ethyl)4(hydroxy(4methylphenyl)methylidene)5(3nitrophenyl)pyrrolidine23dione
(4E)1(2DIMETHYLAMINOETHYL)4(HYDROXY(4METHYLPHENYL)METHYLIDENE)5(3NITROPHENYL)PYRROLIDINE23DIONE
(E)(1(2(dimethylammonio)ethyl)2(3nitrophenyl)45dioxopyrrolidin3ylidene)(4methylphenyl)methanolate
(E)(1(2(DIMETHYLAZANIUMYL)ETHYL)2(3NITROPHENYL)45DIOXOPYRROLIDIN3YLIDENE)(4METHYLPHENYL)METHANOLATE
432011240
CC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CCN(C)C)C3=CC(=CC=C3)(N+)(=O)(O))O
Cc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1cccc(c1)(N+)(=O)(O))CC(NH+)(C)C)(O)
InChI=1SC22H23N3O5c1147915(10814)20(26)1819(1654617(1316)25(29)30)24(121123(2)3)22(28)21(18)27h410131926H1112H213H3b2018+
MFCD20755211
ZINC000102925804
ZINC000102925806
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.