Vitas-M small molecule compound
(E)-{1-[3-(dimethylammonio)propyl]-2-(4-nitrophenyl)-4,5-dioxopyrrolidin-3-ylidene}[4-(prop-2-en-1-yloxy)phenyl]methanolate
Catalog ID
STL047620
SMILES C=CCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)[N+](=O)[O-])CCC[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 C25H27N3O6 MW 465.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N3O6/c1-4-16-34-20-12-8-18(9-13-20)23(29)21-22(17-6-10-19(11-7-17)28(32)33)27(25(31)24(21)30)15-5-14-26(2)3/h4,6-13,22,29H,1,5,14-16H2,2-3H3/b23-21+InChIKey
RIQMETKDQSFHHO-XTQSDGFTSA-NSynonyms
615271-57-3(4E)1(3(DIMETHYLAMINO)PROPYL)4(HYDROXY(4PROP2ENOXYPHENYL)METHYLIDENE)5(4NITROPHENYL)PYRROLIDINE23DIONE
(E)(1(3(dimethylammonio)propyl)2(4nitrophenyl)45dioxopyrrolidin3ylidene)(4(prop2en1yloxy)phenyl)methanolate
(E)(1(3(DIMETHYLAZANIUMYL)PROPYL)2(4NITROPHENYL)45DIOXOPYRROLIDIN3YLIDENE)(4PROP2ENOXYPHENYL)METHANOLATE
1(3(DIMETHYLAMINO)PROPYL)3HYDROXY5(4NITROPHENYL)4((4PROP2ENYLOXYPHENYL)CARBONYL)3PYRROLIN2ONE
615271573
C=CCOc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1ccc(cc1)(N+)(=O)(O))CCC(NH+)(C)C)(O)
CN(C)CCCN1C(C(=C(C2=CC=C(C=C2)OCC=C)O)C(=O)C1=O)C3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC25H27N3O6c1416342012818(91320)23(29)2122(1761019(11717)28(32)33)27(25(31)24(21)30)1551426(2)3h46132229H151416H223H3b2321+
MFCD18249103
ZINC000009271196
ZINC000009271197
Check stock
See real-time availability and sample size for STL047620 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
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