Vitas-M small molecule compound
ethyl 3-(9-ethoxy-3-oxo-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl)benzoate
Catalog ID
STL130314
SMILES CCOC(=O)c1cccc(c1)N1Cc2cccc(c2OCC1=O)OCC
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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 C20H21NO5 MW 355.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21NO5/c1-3-24-17-10-6-8-15-12-21(18(22)13-26-19(15)17)16-9-5-7-14(11-16)20(23)25-4-2/h5-11H,3-4,12-13H2,1-2H3InChIKey
RLDKGEQTFQZCDR-UHFFFAOYSA-NSynonyms
CCOC1=CC=CC2=C1OCC(=O)N(C2)C3=CC=CC(=C3)C(=O)OCC
ethyl3(9ethoxy3oxo23dihydro14benzoxazepin4(5H)yl)benzoate
ethyl3(9ethoxy3oxo5H14benzoxazepin4yl)benzoate
InChI=1SC20H21NO5c1324171068151221(18(22)132619(15)17)1695714(1116)20(23)2542h511H341213H212H3
MFCD20749746
ZINC000067323832
ZINC67323832
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