Vitas-M small molecule compound
(2Z)-2-[4-(methoxycarbonyl)benzylidene]-3-oxo-7-(pyrrolidinium-1-ylmethyl)-2,3-dihydro-1-benzofuran-6-olate
Catalog ID
STK857044
SMILES COC(=O)c1ccc(cc1)/C=C/1\Oc2c(C1=O)ccc(c2C[NH+]1CCCC1)[O-]
Contact us by email for worldwide delivery information, pricing, and real‑time availability. Send us your quotation request, and we will confirm stock levels, provide exact costs and lead times, suggest alternatives or find analogs when helpful, and share any additional specifications you may need.
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 C22H21NO5 MW 379.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21NO5/c1-27-22(26)15-6-4-14(5-7-15)12-19-20(25)16-8-9-18(24)17(21(16)28-19)13-23-10-2-3-11-23/h4-9,12,24H,2-3,10-11,13H2,1H3/b19-12-InChIKey
FHBUBKBWIZJUJX-UNOMPAQXSA-NSynonyms
887214-46-2(2Z)2((4methoxycarbonylphenyl)methylidene)3oxo7(pyrrolidin1ium1ylmethyl)1benzofuran6olate
(2Z)2(4(methoxycarbonyl)benzylidene)3oxo7(pyrrolidinium1ylmethyl)23dihydro1benzofuran6olate
887214462
COC(=O)C1=CC=C(C=C1)C=C2C(=O)C3=C(O2)C(=C(C=C3)(O))C(NH+)4CCCC4
COC(=O)c1ccc(cc1)C=C1Oc2c(C1=O)ccc(c2C(NH+)1CCCC1)(O)
InChI=1SC22H21NO5c12722(26)156414(5715)121920(25)168918(24)17(21(16)2819)132310231123h491224H23101113H21H3b1912
MFCD06745640
ZINC000020624323
Check stock
See real-time availability and sample size for STK857044 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.