Vitas-M small molecule compound
(E)-(3-chloro-4-methoxyphenyl){1-[2-(dimethylammonio)ethyl]-2-(3-nitrophenyl)-4,5-dioxopyrrolidin-3-ylidene}methanolate
Catalog ID
STL148683
SMILES COc1ccc(cc1Cl)/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 C22H22ClN3O6 MW 459.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22ClN3O6/c1-24(2)9-10-25-19(13-5-4-6-15(11-13)26(30)31)18(21(28)22(25)29)20(27)14-7-8-17(32-3)16(23)12-14/h4-8,11-12,19,27H,9-10H2,1-3H3/b20-18+InChIKey
COAWSEHVHNFFFP-CZIZESTLSA-NSynonyms
636988-30-2(4E)4((3chloro4methoxyphenyl)hydroxymethylidene)1(2(dimethylamino)ethyl)5(3nitrophenyl)pyrrolidine23dione
(4E)4((3CHLORO4METHOXYPHENYL)HYDROXYMETHYLIDENE)1(2DIMETHYLAMINOETHYL)5(3NITROPHENYL)PYRROLIDINE23DIONE
(E)(3chloro4methoxyphenyl)(1(2(dimethylammonio)ethyl)2(3nitrophenyl)45dioxopyrrolidin3ylidene)methanolate
(E)(3CHLORO4METHOXYPHENYL)(1(2(DIMETHYLAZANIUMYL)ETHYL)2(3NITROPHENYL)45DIOXOPYRROLIDIN3YLIDENE)METHANOLATE
1(2(DIMETHYLAMINO)ETHYL)4((3CHLORO4METHOXYPHENYL)CARBONYL)3HYDROXY5(3NITROPHENYL)3PYRROLIN2ONE
636988302
CN(C)CCN1C(C(=C(C2=CC(=C(C=C2)OC)Cl)O)C(=O)C1=O)C3=CC(=CC=C3)(N+)(=O)(O)
COc1ccc(cc1Cl)C(=C1C(=O)C(=O)N(C1c1cccc(c1)(N+)(=O)(O))CC(NH+)(C)C)(O)
InChI=1SC22H22ClN3O6c124(2)9102519(1354615(1113)26(30)31)18(21(28)22(25)29)20(27)147817(323)16(23)1214h4811121927H910H213H3b2018+
MFCD20755448
ZINC000008835965
ZINC000008835966
Check stock
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Check stock on Vitas-MAvailable files
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