Vitas-M small molecule compound

2,3-dihydro-1,4-benzodioxin-6-yl[4-(4-nitrophenyl)piperazin-1-yl]methanone

Catalog ID
STK208402
SMILES O=C(c1ccc2c(c1)OCCO2)N1CCN(CC1)c1ccc(cc1)[N+](=O)[O-]

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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 C19H19N3O5 MW 369.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N3O5/c23-19(14-1-6-17-18(13-14)27-12-11-26-17)21-9-7-20(8-10-21)15-2-4-16(5-3-15)22(24)25/h1-6,13H,7-12H2
InChIKey
GEUBZLJNZSAKRV-UHFFFAOYSA-N
Synonyms
361183-86-0
23DIHYDRO14BENZODIOXIN6YL(4(4NITROPHENYL)PIPERAZIN1YL)METHANONE
2H3HBENZO(E)14DIOXIN6YL4(4NITROPHENYL)PIPERAZINYLKETONE
361183860
C1CN(CCN1C2=CC=C(C=C2)(N+)(=O)(O))C(=O)C3=CC4=C(C=C3)OCCO4
InChI=1SC19H19N3O5c2319(14161718(1314)2712112617)219720(81021)152416(5315)22(24)25h1613H712H2
MFCD02209517
O=C(c1ccc2c(c1)OCCO2)N1CCN(CC1)c1ccc(cc1)(N+)(=O)(O)
ZINC000004746797
ZINC04746797
ZINC4746797

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Available files

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