Vitas-M small molecule compound

1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-ethoxyethanone

Catalog ID
STK151383
SMILES CCOCC(=O)N1CCN(CC1)Cc1ccc2c(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 C16H22N2O4 MW 306.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H22N2O4/c1-2-20-11-16(19)18-7-5-17(6-8-18)10-13-3-4-14-15(9-13)22-12-21-14/h3-4,9H,2,5-8,10-12H2,1H3
InChIKey
CTIYJTNTZQYPSU-UHFFFAOYSA-N
Synonyms

1(4(13BENZODIOXOL5YLMETHYL)PIPERAZIN1YL)2ETHOXYETHANONE
CCOCC(=O)N1CCN(CC1)CC2=CC3=C(C=C2)OCO3
InChI=1SC16H22N2O4c12201116(19)187517(6818)1013341415(913)22122114h349H2581012H21H3
MFCD03929410
ZINC000019849749
ZINC19849749

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.