Vitas-M small molecule compound
(2Z)-2-(3,4-dichlorobenzylidene)-7-(morpholin-4-ium-4-ylmethyl)-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Catalog ID
STK591010
SMILES O=C1/C(=C/c2ccc(c(c2)Cl)Cl)/Oc2c1ccc(c2C[NH+]1CCOCC1)[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 C20H17Cl2NO4 MW 406.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17Cl2NO4/c21-15-3-1-12(9-16(15)22)10-18-19(25)13-2-4-17(24)14(20(13)27-18)11-23-5-7-26-8-6-23/h1-4,9-10,24H,5-8,11H2/b18-10-InChIKey
CKNABQJOFVJFPH-ZDLGFXPLSA-NSynonyms
900272-44-8(2Z)2(34dichlorobenzylidene)7(morpholin4ium4ylmethyl)3oxo23dihydro1benzofuran6olate
C1COCCN1CC2=C(C=CC3=C2OC(=CC4=CC(=C(C=C4)Cl)Cl)C3=O)O
InChI=1SC20H17Cl2NO4c21153112(916(15)22)101819(25)132417(24)14(20(13)2718)112357268623h1491024H5811H2b1810
MFCD06611050
O=C1C(=Cc2ccc(c(c2)Cl)Cl)Oc2c1ccc(c2C(NH+)1CCOCC1)(O)
ZINC000002352520
Check stock
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