Vitas-M small molecule compound
2-(2-bromo-4-ethylphenoxy)-1-[4-(4-nitrophenyl)piperazin-1-yl]ethanone
Catalog ID
STK225454
SMILES CCc1ccc(c(c1)Br)OCC(=O)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 C20H22BrN3O4 MW 448.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22BrN3O4/c1-2-15-3-8-19(18(21)13-15)28-14-20(25)23-11-9-22(10-12-23)16-4-6-17(7-5-16)24(26)27/h3-8,13H,2,9-12,14H2,1H3InChIKey
QOVQPPHDRSFQTD-UHFFFAOYSA-NSynonyms
2(2bromo4ethylphenoxy)1(4(4nitrophenyl)piperazin1yl)ethanone
CCC1=CC(=C(C=C1)OCC(=O)N2CCN(CC2)C3=CC=C(C=C3)(N+)(=O)(O))Br
CCc1ccc(c(c1)Br)OCC(=O)N1CCN(CC1)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC20H22BrN3O4c12153819(18(21)1315)281420(25)2311922(101223)164617(7516)24(26)27h3813H291214H21H3
MFCD03997963
ZINC000009288310
ZINC09288310
ZINC9288310
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