Vitas-M small molecule compound
4-(4-chloro-2-methylphenoxy)-1-[4-(4-nitrophenyl)piperazin-1-yl]butan-1-one
Catalog ID
STK117126
SMILES Clc1ccc(c(c1)C)OCCCC(=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 C21H24ClN3O4 MW 417.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24ClN3O4/c1-16-15-17(22)4-9-20(16)29-14-2-3-21(26)24-12-10-23(11-13-24)18-5-7-19(8-6-18)25(27)28/h4-9,15H,2-3,10-14H2,1H3InChIKey
OQJDKAYHBANYLV-UHFFFAOYSA-NSynonyms
540792-34-54(4CHLORO2METHYLPHENOXY)1(4(4NITROPHENYL)PIPERAZIN1YL)BUTAN1ONE
4(4CHLORO2METHYLPHENOXY)1(4(4NITROPHENYL)PIPERAZINYL)BUTAN1ONE
540792345
CC1=C(C=CC(=C1)Cl)OCCCC(=O)N2CCN(CC2)C3=CC=C(C=C3)(N+)(=O)(O)
Clc1ccc(c(c1)C)OCCCC(=O)N1CCN(CC1)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC21H24ClN3O4c1161517(22)4920(16)29142321(26)24121023(111324)185719(8618)25(27)28h4915H231014H21H3
MFCD03363417
ZINC000004675870
ZINC04675870
ZINC4675870
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