Vitas-M small molecule compound
4-(6-bromo-4-oxo-4H-3,1-benzoxazin-2-yl)-2-methoxyphenyl acetate
Catalog ID
STK001510
SMILES COc1cc(ccc1OC(=O)C)c1nc2ccc(cc2c(=O)o1)Br
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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 C17H12BrNO5 MW 390.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12BrNO5/c1-9(20)23-14-6-3-10(7-15(14)22-2)16-19-13-5-4-11(18)8-12(13)17(21)24-16/h3-8H,1-2H3InChIKey
HIXJOACXVKGBMO-UHFFFAOYSA-NSynonyms
(4(6BROMO4OXO31BENZOXAZIN2YL)2METHOXYPHENYL)ACETATE
4(6BROMO4OXO4H31BENZOXAZIN2YL)2METHOXYPHENYLACETATE
CC(=O)OC1=C(C=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=O)O2)OC
COc1cc(ccc1OC(=O)C)c1nc2ccc(cc2c(=O)o1)Br
InChI=1SC17H12BrNO5c19(20)23146310(715(14)222)1619135411(18)812(13)17(21)2416h38H12H3
MFCD03369595
STK001510
ZINC000001129116
ZINC01129116
ZINC1129116
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