Vitas-M small molecule compound

ethyl 6-chloro-4-[(dimethylamino)methyl]-5-hydroxy-2-methyl-1-benzofuran-3-carboxylate

Catalog ID
STL322922
SMILES CCOC(=O)c1c(C)oc2c1c(CN(C)C)c(c(c2)Cl)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 C15H18ClNO4 MW 311.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H18ClNO4/c1-5-20-15(19)12-8(2)21-11-6-10(16)14(18)9(13(11)12)7-17(3)4/h6,18H,5,7H2,1-4H3
InChIKey
UBMIKLUSHCSWBA-UHFFFAOYSA-N
Synonyms
56879-64-2
3BENZOFURANCARBOXYLICACID6CHLORO4(DIMETHYLAMINOMETHYL)5HYDROXY2METHYLETHYLESTER
56879642
6chloro4((dimethylazaniumyl)methyl)3ethoxycarbonyl2methyl1benzofuran5olate
6CHLORO4(DIMETHYLAMINOMETHYL)5HYDROXY2METHYL3BENZOFURANCARBOXYLICACIDETHYLESTER
6CHLORO4DIMETHYLAMINOMETHYL5HYDROXY2METHYL3BENZOFURANCARBOXYLICACIDETHYLESTER
6CHLORO4DIMETHYLAMINOMETHYL5HYDROXY2METHYLBENZOFURAN3CARBOXYLICACIDETHYLESTER
CCOC(=O)C1=C(OC2=CC(=C(C(=C21)C(NH+)(C)C)(O))Cl)C
ethyl6chloro4((dimethylamino)methyl)5hydroxy2methyl1benzofuran3carboxylate
ethyl6chloro4((dimethylamino)methyl)5hydroxy2methylbenzofuran3carboxylate
ETHYL6CHLORO4(DIMETHYLAMINOMETHYL)5HYDROXY2METHYL1BENZOFURAN3CARBOXYLATE
InChI=1SC15H18ClNO4c152015(19)128(2)2111610(16)14(18)9(13(11)12)717(3)4h618H57H214H3
MFCD01241847
ZINC000020792833
ZINC20792833

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Available files

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