Vitas-M small molecule compound
(2Z)-2-(1,3-benzodioxol-5-ylmethylidene)-7-methyl-3-oxo-2,3-dihydro-1-benzofuran-6-yl morpholine-4-carboxylate
Catalog ID
STK852815
SMILES O=C(N1CCOCC1)Oc1ccc2c(c1C)O/C(=C\c1ccc3c(c1)OCO3)/C2=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 C22H19NO7 MW 409.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19NO7/c1-13-16(30-22(25)23-6-8-26-9-7-23)5-3-15-20(24)19(29-21(13)15)11-14-2-4-17-18(10-14)28-12-27-17/h2-5,10-11H,6-9,12H2,1H3/b19-11-InChIKey
PNPBJCGKAPDGBU-ODLFYWEKSA-NSynonyms
900267-82-5((2Z)2(13BENZODIOXOL5YLMETHYLIDENE)7METHYL3OXO1BENZOFURAN6YL)MORPHOLINE4CARBOXYLATE
(2Z)2(13benzodioxol5ylmethylidene)7methyl3oxo23dihydro1benzofuran6ylmorpholine4carboxylate
(Z)2(benzo(d)(13)dioxol5ylmethylene)7methyl3oxo23dihydrobenzofuran6ylmorpholine4carboxylate
2(2HBENZO(34D)13DIOXOLEN5YLMETHYLENE)7METHYL3OXOBENZO(34B)FURAN6YLMORPHOLINE4CARBOXYLATE
900267825
CC1=C(C=CC2=C1OC(=CC3=CC4=C(C=C3)OCO4)C2=O)OC(=O)N5CCOCC5
InChI=1SC22H19NO7c11316(3022(25)2368269723)531520(24)19(2921(13)15)1114241718(1014)28122717h251011H6912H21H3b1911
MFCD06612289
O=C(N1CCOCC1)Oc1ccc2c(c1C)OC(=Cc1ccc3c(c1)OCO3)C2=O
ZINC000005443460
ZINC05443460
ZINC5443460
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