Vitas-M small molecule compound
4-(azepanium-1-ylmethyl)-3-(ethoxycarbonyl)-2-phenyl-1-benzofuran-5-olate
Catalog ID
STK621441
SMILES CCOC(=O)c1c(oc2c1c(C[NH+]1CCCCCC1)c(cc2)[O-])c1ccccc1
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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 C24H27NO4 MW 393.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27NO4/c1-2-28-24(27)22-21-18(16-25-14-8-3-4-9-15-25)19(26)12-13-20(21)29-23(22)17-10-6-5-7-11-17/h5-7,10-13,26H,2-4,8-9,14-16H2,1H3InChIKey
WCGCXQQWRRQKEG-UHFFFAOYSA-NSynonyms
300556-97-24(azepanium1ylmethyl)3(ethoxycarbonyl)2phenyl1benzofuran5olate
CCOC(=O)c1c(oc2c1c(C(NH+)1CCCCCC1)c(cc2)(O))c1ccccc1
ETHYL4(AZAPERHYDROEPINYLMETHYL)5HYDROXY2PHENYLBENZO(B)FURAN3CARBOXYLATE
MFCD01847190
ZINC000000634131
ZINC634131
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