Vitas-M small molecule compound
ethyl 5-hydroxy-2-methyl-7-(4-methyl-2-nitrophenyl)-1-benzofuran-3-carboxylate
Catalog ID
STK687783
SMILES CCOC(=O)c1c(C)oc2c1cc(O)cc2c1ccc(cc1[N+](=O)[O-])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 C19H17NO6 MW 355.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17NO6/c1-4-25-19(22)17-11(3)26-18-14(8-12(21)9-15(17)18)13-6-5-10(2)7-16(13)20(23)24/h5-9,21H,4H2,1-3H3InChIKey
UDYWRXFXDWDVPP-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(OC2=C(C=C(C=C12)O)C3=C(C=C(C=C3)C)(N+)(=O)(O))C
CCOC(=O)c1c(C)oc2c1cc(O)cc2c1ccc(cc1(N+)(=O)(O))C
ETHYL5HYDROXY2METHYL7(4METHYL2NITROPHENYL)1BENZOFURAN3CARBOXYLATE
InChI=1SC19H17NO6c142519(22)1711(3)261814(812(21)915(17)18)136510(2)716(13)20(23)24h5921H4H213H3
MFCD07021743
ZINC000004754104
ZINC04754104
ZINC4754104
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