Vitas-M small molecule compound

ethyl 4-[(dimethylamino)methyl]-5-hydroxy-2-phenyl-1-benzofuran-3-carboxylate

Catalog ID
STK280141
SMILES CCOC(=O)c1c(oc2c1c(CN(C)C)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 C20H21NO4 MW 339.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21NO4/c1-4-24-20(23)18-17-14(12-21(2)3)15(22)10-11-16(17)25-19(18)13-8-6-5-7-9-13/h5-11,22H,4,12H2,1-3H3
InChIKey
JXUHSUSCLWIKEW-UHFFFAOYSA-N
Synonyms
95696-19-8
2PHENYL3CARBETHOXY4DIMETHYLAMINOMETHYL5HYDROXYBENZOFURAN
2PHENYL4((DIMETHYLAMINO)METHYL)5HYDROXY3BENZOFURANCARBOXYLICACIDETHYLESTER
3BENZOFURANCARBOXYLICACID4((DIMETHYLAMINO)METHYL)5HYDROXY2PHENYLETHYLESTER
4((dimethylazaniumyl)methyl)3ethoxycarbonyl2phenyl1benzofuran5olate
95696198
BENZOFURANE3CARBOXYLICACID5HYDROXY4DIMETHYLAMINOMETHYL2PHENYLETHYLESTER
CCOC(=O)C1=C(OC2=C1C(=C(C=C2)(O))C(NH+)(C)C)C3=CC=CC=C3
ETHYL4((DIMETHYLAMINO)METHYL)5HYDROXY2PHENYL1BENZO(B)FURAN3CARBOXYLATE
ethyl4((dimethylamino)methyl)5hydroxy2phenyl1benzofuran3carboxylate
ETHYL4((DIMETHYLAMINO)METHYL)5HYDROXY2PHENYLBENZO(B)FURAN3CARBOXYLATE
ethyl4((dimethylamino)methyl)5hydroxy2phenylbenzofuran3carboxylate
ETHYL4(DIMETHYLAMINOMETHYL)5HYDROXY2PHENYL1BENZOFURAN3CARBOXYLATE
InChI=1SC20H21NO4c142420(23)181714(1221(2)3)15(22)101116(17)2519(18)138657913h51122H412H213H3
MFCD00377603
PHENICABERAN(WHODD)
PHENICABERANUM
ZINC48956

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.