Vitas-M small molecule compound
1-[4-(2-chloro-4-nitrophenyl)piperazin-1-yl]-2-(4-chlorophenoxy)ethanone
Catalog ID
STL378107
SMILES Clc1ccc(cc1)OCC(=O)N1CCN(CC1)c1ccc(cc1Cl)[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 C18H17Cl2N3O4 MW 410.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17Cl2N3O4/c19-13-1-4-15(5-2-13)27-12-18(24)22-9-7-21(8-10-22)17-6-3-14(23(25)26)11-16(17)20/h1-6,11H,7-10,12H2InChIKey
PMISWSOKBPDMBO-UHFFFAOYSA-NSynonyms
1(4(2chloro4nitrophenyl)piperazin1yl)2(4chlorophenoxy)ethanone
C1CN(CCN1C2=C(C=C(C=C2)(N+)(=O)(O))Cl)C(=O)COC3=CC=C(C=C3)Cl
Clc1ccc(cc1)OCC(=O)N1CCN(CC1)c1ccc(cc1Cl)(N+)(=O)(O)
InChI=1SC18H17Cl2N3O4c19131415(5213)271218(24)229721(81022)176314(23(25)26)1116(17)20h1611H71012H2
MFCD02070081
ZINC000005101208
ZINC05101208
ZINC5101208
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