Vitas-M small molecule compound
2-[(E)-2-(5-bromo-2-methoxyphenyl)ethenyl]-4H-3,1-benzoxazin-4-one
Catalog ID
STK224610
SMILES COc1ccc(cc1/C=C/c1nc2ccccc2c(=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 C17H12BrNO3 MW 358.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12BrNO3/c1-21-15-8-7-12(18)10-11(15)6-9-16-19-14-5-3-2-4-13(14)17(20)22-16/h2-10H,1H3/b9-6+InChIKey
YTMDMUVBKHIVJT-RMKNXTFCSA-NSynonyms
2((E)2(5BROMO2METHOXYPHENYL)ETHENYL)31BENZOXAZIN4ONE
2((E)2(5bromo2methoxyphenyl)ethenyl)4H31benzoxazin4one
COC1=C(C=C(C=C1)Br)C=CC2=NC3=CC=CC=C3C(=O)O2
COc1ccc(cc1C=Cc1nc2ccccc2c(=O)o1)Br
InChI=1SC17H12BrNO3c121158712(18)1011(15)69161914532413(14)17(20)2216h210H1H3b96+
MFCD03699088
ZINC000004223215
ZINC04223215
ZINC4223215
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