Vitas-M small molecule compound
2-(azepan-1-ylmethyl)-5-(2-oxo-2-phenylethoxy)-4H-pyran-4-one
Catalog ID
STL319681
SMILES O=C(c1ccccc1)COc1coc(cc1=O)CN1CCCCCC1
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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 C20H23NO4 MW 341.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23NO4/c22-18-12-17(13-21-10-6-1-2-7-11-21)24-15-20(18)25-14-19(23)16-8-4-3-5-9-16/h3-5,8-9,12,15H,1-2,6-7,10-11,13-14H2InChIKey
BIPVYIUJKUMMJL-UHFFFAOYSA-NSynonyms
1435998-96-11435998961
2(azepan1ylmethyl)5(2oxo2phenylethoxy)4Hpyran4one
2(azepan1ylmethyl)5phenacyloxypyran4one
C1CCCN(CC1)CC2=CC(=O)C(=CO2)OCC(=O)C3=CC=CC=C3
InChI=1SC20H23NO4c22181217(13211061271121)241520(18)251419(23)168435916h35891215H126710111314H2
MFCD23138622
ZINC000095480260
ZINC95480260
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