Vitas-M small molecule compound

(2Z)-2-(5-bromo-2-methoxybenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl morpholine-4-carboxylate

Catalog ID
STK924178
SMILES COc1ccc(cc1/C=C/1\Oc2c(C1=O)ccc(c2)OC(=O)N1CCOCC1)Br

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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 C21H18BrNO6 MW 460.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18BrNO6/c1-26-17-5-2-14(22)10-13(17)11-19-20(24)16-4-3-15(12-18(16)29-19)28-21(25)23-6-8-27-9-7-23/h2-5,10-12H,6-9H2,1H3/b19-11-
InChIKey
BRHJDIRSDVKSCH-ODLFYWEKSA-N
Synonyms
622794-44-9
((2Z)2((5BROMO2METHOXYPHENYL)METHYLIDENE)3OXO1BENZOFURAN6YL)MORPHOLINE4CARBOXYLATE
(2Z)2(5bromo2methoxybenzylidene)3oxo23dihydro1benzofuran6ylmorpholine4carboxylate
(Z)2(5bromo2methoxybenzylidene)3oxo23dihydrobenzofuran6ylmorpholine4carboxylate
2((5BROMO2METHOXYPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YLMORPHOLINE4CARBOXYLATE
622794449
COC1=C(C=C(C=C1)Br)C=C2C(=O)C3=C(O2)C=C(C=C3)OC(=O)N4CCOCC4
COc1ccc(cc1C=C1Oc2c(C1=O)ccc(c2)OC(=O)N1CCOCC1)Br
InChI=1SC21H18BrNO6c126175214(22)1013(17)111920(24)164315(1218(16)2919)2821(25)2368279723h251012H69H21H3b1911
MFCD04169763
ZINC000002417356
ZINC02417356
ZINC2417356

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.