Vitas-M small molecule compound
2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl 1,3-benzodioxole-5-carboxylate
Catalog ID
STL059647
SMILES COc1ccccc1N1CCN(CC1)C(=O)COC(=O)c1ccc2c(c1)OCO2
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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 C21H22N2O6 MW 398.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O6/c1-26-17-5-3-2-4-16(17)22-8-10-23(11-9-22)20(24)13-27-21(25)15-6-7-18-19(12-15)29-14-28-18/h2-7,12H,8-11,13-14H2,1H3InChIKey
NDLUUXDOYQKGCO-UHFFFAOYSA-NSynonyms
(2(4(2METHOXYPHENYL)PIPERAZIN1YL)2OXOETHYL)13BENZODIOXOLE5CARBOXYLATE
2(4(2methoxyphenyl)piperazin1yl)2oxoethyl13benzodioxole5carboxylate
COC1=CC=CC=C1N2CCN(CC2)C(=O)COC(=O)C3=CC4=C(C=C3)OCO4
InChI=1SC21H22N2O6c12617532416(17)2281023(11922)20(24)132721(25)15671819(1215)29142818h2712H8111314H21H3
MFCD18193176
ZINC000008068670
ZINC08068670
ZINC8068670
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