Vitas-M small molecule compound
[4-(5-bromo-2-methoxybenzyl)piperazin-1-yl](4-nitrophenyl)methanone
Catalog ID
STK194101
SMILES COc1ccc(cc1CN1CCN(CC1)C(=O)c1ccc(cc1)[N+](=O)[O-])Br
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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 C19H20BrN3O4 MW 434.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20BrN3O4/c1-27-18-7-4-16(20)12-15(18)13-21-8-10-22(11-9-21)19(24)14-2-5-17(6-3-14)23(25)26/h2-7,12H,8-11,13H2,1H3InChIKey
JGXXFWDEMKXQCL-UHFFFAOYSA-NSynonyms
(4((5BROMO2METHOXYPHENYL)METHYL)PIPERAZIN1YL)(4NITROPHENYL)METHANONE
(4(5BROMO2METHOXYBENZYL)PIPERAZIN1YL)(4NITROPHENYL)METHANONE
COC1=C(C=C(C=C1)Br)CN2CCN(CC2)C(=O)C3=CC=C(C=C3)(N+)(=O)(O)
COc1ccc(cc1CN1CCN(CC1)C(=O)c1ccc(cc1)(N+)(=O)(O))Br
InChI=1SC19H20BrN3O4c127187416(20)1215(18)132181022(11921)19(24)142517(6314)23(25)26h2712H81113H21H3
MFCD03713366
ZINC000019889255
ZINC19889255
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