Vitas-M small molecule compound

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

Catalog ID
STK923703
SMILES COc1cc(ccc1OC)/C=C/1\Oc2c(C1=O)ccc(c2)OC(=O)N1CCOCC1

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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 C22H21NO7 MW 411.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21NO7/c1-26-17-6-3-14(11-19(17)27-2)12-20-21(24)16-5-4-15(13-18(16)30-20)29-22(25)23-7-9-28-10-8-23/h3-6,11-13H,7-10H2,1-2H3/b20-12-
InChIKey
BPOLWCMPCFZSEI-NDENLUEZSA-N
Synonyms
859139-03-0
((2Z)2((34DIMETHOXYPHENYL)METHYLIDENE)3OXO1BENZOFURAN6YL)MORPHOLINE4CARBOXYLATE
(2Z)2(34dimethoxybenzylidene)3oxo23dihydro1benzofuran6ylmorpholine4carboxylate
(Z)2(34dimethoxybenzylidene)3oxo23dihydrobenzofuran6ylmorpholine4carboxylate
2((34DIMETHOXYPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YLMORPHOLINE4CARBOXYLATE
859139030
COC1=C(C=C(C=C1)C=C2C(=O)C3=C(O2)C=C(C=C3)OC(=O)N4CCOCC4)OC
COc1cc(ccc1OC)C=C1Oc2c(C1=O)ccc(c2)OC(=O)N1CCOCC1
InChI=1SC22H21NO7c126176314(1119(17)272)122021(24)165415(1318(16)3020)2922(25)23792810823h361113H710H212H3b2012
MFCD04146901
ZINC000012637021
ZINC12637021

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Available files

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