Vitas-M small molecule compound

2-(3,4-dimethylphenoxy)-1-[4-(4-nitrophenyl)piperazin-1-yl]ethanone

Catalog ID
STK014225
SMILES O=C(N1CCN(CC1)c1ccc(cc1)[N+](=O)[O-])COc1ccc(c(c1)C)C

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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 C20H23N3O4 MW 369.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N3O4/c1-15-3-8-19(13-16(15)2)27-14-20(24)22-11-9-21(10-12-22)17-4-6-18(7-5-17)23(25)26/h3-8,13H,9-12,14H2,1-2H3
InChIKey
ALRYDYJOMIQSLN-UHFFFAOYSA-N
Synonyms

2(34DIMETHYLPHENOXY)1(4(4NITROPHENYL)PIPERAZIN1YL)ETHANONE
2(34DIMETHYLPHENOXY)1(4(4NITROPHENYL)PIPERAZINYL)ETHAN1ONE
CC1=C(C=C(C=C1)OCC(=O)N2CCN(CC2)C3=CC=C(C=C3)(N+)(=O)(O))C
InChI=1SC20H23N3O4c1153819(1316(15)2)271420(24)2211921(101222)174618(7517)23(25)26h3813H91214H212H3
MFCD02218078
O=C(N1CCN(CC1)c1ccc(cc1)(N+)(=O)(O))COc1ccc(c(c1)C)C
STK014225
ZINC000003904048
ZINC03904048
ZINC3904048

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Available files

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