Vitas-M small molecule compound

ethyl 4-(9-methoxy-3-oxo-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl)benzoate

Catalog ID
STL130285
SMILES CCOC(=O)c1ccc(cc1)N1Cc2cccc(c2OCC1=O)OC

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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 C19H19NO5 MW 341.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19NO5/c1-3-24-19(22)13-7-9-15(10-8-13)20-11-14-5-4-6-16(23-2)18(14)25-12-17(20)21/h4-10H,3,11-12H2,1-2H3
InChIKey
OWXITFXWJOPGQD-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=CC=C(C=C1)N2CC3=C(C(=CC=C3)OC)OCC2=O
ethyl4(9methoxy3oxo23dihydro14benzoxazepin4(5H)yl)benzoate
ethyl4(9methoxy3oxo5H14benzoxazepin4yl)benzoate
InChI=1SC19H19NO5c132419(22)137915(10813)20111454616(232)18(14)251217(20)21h410H31112H212H3
MFCD20749717
ZINC000065184477
ZINC65184477

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Available files

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