Vitas-M small molecule compound
2-(2,5-dichlorophenoxy)-1-[4-(4-nitrophenyl)piperazin-1-yl]butan-1-one
Catalog ID
STK427013
SMILES CCC(C(=O)N1CCN(CC1)c1ccc(cc1)[N+](=O)[O-])Oc1cc(Cl)ccc1Cl
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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 C20H21Cl2N3O4 MW 438.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21Cl2N3O4/c1-2-18(29-19-13-14(21)3-8-17(19)22)20(26)24-11-9-23(10-12-24)15-4-6-16(7-5-15)25(27)28/h3-8,13,18H,2,9-12H2,1H3InChIKey
GVWJKMWQGXWLOO-UHFFFAOYSA-NSynonyms
2(25dichlorophenoxy)1(4(4nitrophenyl)piperazin1yl)butan1one
2(25DICHLOROPHENOXY)1(4(4NITROPHENYL)PIPERAZINYL)BUTAN1ONE
CCC(C(=O)N1CCN(CC1)c1ccc(cc1)(N+)(=O)(O))Oc1cc(Cl)ccc1Cl
CCC(C(=O)N1CCN(CC1)C2=CC=C(C=C2)(N+)(=O)(O))OC3=C(C=CC(=C3)Cl)Cl
InChI=1SC20H21Cl2N3O4c1218(29191314(21)3817(19)22)20(26)2411923(101224)154616(7515)25(27)28h381318H2912H21H3
MFCD02612398
ZINC000017101906
ZINC000017101908
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