Vitas-M small molecule compound
1-[4-(2-methyl-4-nitrophenyl)piperazin-1-yl]-2-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethanone
Catalog ID
STK172053
SMILES O=C(N1CCN(CC1)c1ccc(cc1C)[N+](=O)[O-])CC12CC3CC(C2)CC(C1)C3
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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 C23H31N3O3 MW 397.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H31N3O3/c1-16-8-20(26(28)29)2-3-21(16)24-4-6-25(7-5-24)22(27)15-23-12-17-9-18(13-23)11-19(10-17)14-23/h2-3,8,17-19H,4-7,9-15H2,1H3InChIKey
QNVXIZKZOFZMAK-UHFFFAOYSA-NSynonyms
1(4(2methyl4nitrophenyl)piperazin1yl)2(tricyclo(3311~37~)dec1yl)ethanone
2(1ADAMANTYL)1(4(2METHYL4NITROPHENYL)PIPERAZIN1YL)ETHANONE
2ADAMANTANYL1(4(2METHYL4NITROPHENYL)PIPERAZINYL)ETHAN1ONE
CC1=C(C=CC(=C1)(N+)(=O)(O))N2CCN(CC2)C(=O)CC34CC5CC(C3)CC(C5)C4
InChI=1SC23H31N3O3c116820(26(28)29)2321(16)244625(7524)22(27)15231217918(1323)1119(1017)1423h2381719H47915H21H3
MFCD05661686
O=C(N1CCN(CC1)c1ccc(cc1C)(N+)(=O)(O))CC12CC3CC(C2)CC(C1)C3
ZINC000004125129
ZINC04125129
ZINC4125129
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