Vitas-M small molecule compound
(2E)-3-(1,3-benzodioxol-5-yl)-1-(4-ethylpiperazin-1-yl)prop-2-en-1-one
Catalog ID
STK002709
SMILES CCN1CCN(CC1)C(=O)/C=C/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 C16H20N2O3 MW 288.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N2O3/c1-2-17-7-9-18(10-8-17)16(19)6-4-13-3-5-14-15(11-13)21-12-20-14/h3-6,11H,2,7-10,12H2,1H3/b6-4+InChIKey
NRCKMILNOSXQBK-GQCTYLIASA-NSynonyms
1351436-59-3(2E)3(13BENZODIOXOL5YL)1(4ETHYLPIPERAZIN1YL)PROP2EN1ONE
(E)3(13BENZODIOXOL5YL)1(4ETHYLPIPERAZIN1YL)PROP2EN1ONE
1351436593
3BENZO(13)DIOXOL5YL1(4ETHYLPIPERAZIN1YL)PROPENONE
CCN1CCN(CC1)C(=O)C=Cc1ccc2c(c1)OCO2
CCN1CCN(CC1)C(=O)C=CC2=CC3=C(C=C2)OCO3
InChI=1SC16H20N2O3c12177918(10817)16(19)6413351415(1113)21122014h3611H271012H21H3b64+
MFCD03043029
STK002709
ZINC000055378639
ZINC55378639
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