Vitas-M small molecule compound
(2Z)-2-(1,3-benzodioxol-5-ylmethylidene)-7-[(diethylamino)methyl]-6-hydroxy-1-benzofuran-3(2H)-one
Catalog ID
STK925157
SMILES CCN(Cc1c(O)ccc2c1O/C(=C\c1ccc3c(c1)OCO3)/C2=O)CC
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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 C21H21NO5 MW 367.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21NO5/c1-3-22(4-2)11-15-16(23)7-6-14-20(24)19(27-21(14)15)10-13-5-8-17-18(9-13)26-12-25-17/h5-10,23H,3-4,11-12H2,1-2H3/b19-10-InChIKey
DRBMHKRCQJFUBS-GRSHGNNSSA-NSynonyms
859663-10-8(2Z)2(13benzodioxol5ylmethylidene)7((diethylamino)methyl)6hydroxy1benzofuran3(2H)one
(2Z)2(13benzodioxol5ylmethylidene)7((diethylazaniumyl)methyl)3oxo1benzofuran6olate
(2Z)2(13BENZODIOXOL5YLMETHYLIDENE)7(DIETHYLAMINOMETHYL)6HYDROXY1BENZOFURAN3ONE
(Z)2(benzo(d)(13)dioxol5ylmethylene)7((diethylamino)methyl)6hydroxybenzofuran3(2H)one
2(2HBENZO(34D)13DIOXOLEN5YLMETHYLENE)7((DIETHYLAMINO)METHYL)6HYDROXYBENZO(B)FURAN3ONE
CC(NH+)(CC)CC1=C(C=CC2=C1OC(=CC3=CC4=C(C=C3)OCO4)C2=O)(O)
CCN(Cc1c(O)ccc2c1OC(=Cc1ccc3c(c1)OCO3)C2=O)CC
InChI=1SC21H21NO5c1322(42)111516(23)761420(24)19(2721(14)15)1013581718(913)26122517h51023H341112H212H3b1910
ZINC20611092
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