Vitas-M small molecule compound
(2E)-3-(5-bromo-2-{2-oxo-2-[(2-phenylethyl)amino]ethoxy}phenyl)prop-2-enoic acid
Catalog ID
STK398146
SMILES O=C(COc1ccc(cc1/C=C/C(=O)O)Br)NCCc1ccccc1
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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 C19H18BrNO4 MW 404.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18BrNO4/c20-16-7-8-17(15(12-16)6-9-19(23)24)25-13-18(22)21-11-10-14-4-2-1-3-5-14/h1-9,12H,10-11,13H2,(H,21,22)(H,23,24)/b9-6+InChIKey
QXVHFMSCXCLPPZ-RMKNXTFCSA-NSynonyms
1076196-72-9(2E)3(5bromo2(2oxo2((2phenylethyl)amino)ethoxy)phenyl)prop2enoicacid
(E)3(5bromo2(2oxo2(2phenylethylamino)ethoxy)phenyl)prop2enoicacid
1076196729
C1=CC=C(C=C1)CCNC(=O)COC2=C(C=C(C=C2)Br)C=CC(=O)O
InChI=1SC19H18BrNO4c20167817(15(1216)6919(23)24)251318(22)211110144213514h1912H101113H2(H2122)(H2324)b96+
MFCD02257619
O=C(COc1ccc(cc1C=CC(=O)O)Br)NCCc1ccccc1
ZINC000022077328
ZINC22077328
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