Vitas-M small molecule compound
7-bromo-4-(3,4-diethoxybenzyl)-4,5-dihydro-1,4-benzoxazepin-3(2H)-one
Catalog ID
STL130244
SMILES CCOc1cc(ccc1OCC)CN1Cc2cc(Br)ccc2OCC1=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 C20H22BrNO4 MW 420.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22BrNO4/c1-3-24-18-7-5-14(9-19(18)25-4-2)11-22-12-15-10-16(21)6-8-17(15)26-13-20(22)23/h5-10H,3-4,11-13H2,1-2H3InChIKey
AJDDFAHEGBMMKM-UHFFFAOYSA-NSynonyms
1326864-81-61326864816
7bromo4((34diethoxyphenyl)methyl)5H14benzoxazepin3one
7bromo4(34diethoxybenzyl)45dihydro14benzoxazepin3(2H)one
CCOC1=C(C=C(C=C1)CN2CC3=C(C=CC(=C3)Br)OCC2=O)OCC
InChI=1SC20H22BrNO4c1324187514(919(18)2542)112212151016(21)6817(15)261320(22)23h510H341113H212H3
MFCD20749676
ZINC000065184428
ZINC65184428
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