Vitas-M small molecule compound
1-(1,3-benzodioxol-5-yl)-2-[4-(3-methoxyphenyl)piperazin-1-yl]ethanone
Catalog ID
STL102807
SMILES COc1cccc(c1)N1CCN(CC1)CC(=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 C20H22N2O4 MW 354.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N2O4/c1-24-17-4-2-3-16(12-17)22-9-7-21(8-10-22)13-18(23)15-5-6-19-20(11-15)26-14-25-19/h2-6,11-12H,7-10,13-14H2,1H3InChIKey
QWZITGOCYPEXAB-UHFFFAOYSA-NSynonyms
1(13benzodioxol5yl)2(4(3methoxyphenyl)piperazin1yl)ethanone
COC1=CC=CC(=C1)N2CCN(CC2)CC(=O)C3=CC4=C(C=C3)OCO4
InChI=1SC20H22N2O4c1241742316(1217)229721(81022)1318(23)15561920(1115)26142519h261112H7101314H21H3
MFCD20732534
ZINC000059308137
ZINC59308137
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