Vitas-M small molecule compound
2-hydroxy-4-{[(E)-2-(3-methyl-2-oxocyclohexyl)ethenyl]amino}benzoic acid
Catalog ID
STL560250
SMILES O=C1C(CCCC1C)/C=C/Nc1ccc(c(c1)O)C(=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 C16H19NO4 MW 289.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19NO4/c1-10-3-2-4-11(15(10)19)7-8-17-12-5-6-13(16(20)21)14(18)9-12/h5-11,17-18H,2-4H2,1H3,(H,20,21)/b8-7+InChIKey
HPNWCUFVPULAMQ-BQYQJAHWSA-NSynonyms
139030164
2hydroxy4(((E)2(3methyl2oxocyclohexyl)ethenyl)amino)benzoicacid
InChI=1SC16H19NO4c11032411(15(10)19)7817125613(16(20)21)14(18)912h5111718H24H21H3(H2021)b87+
MFCD32221005
ZINC001776111225
ZINC001776111228
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